molecule_smiles
stringlengths 2
3.43k
| SELFIES
stringlengths 5
9.02k
|
|---|---|
CCCCCCC(C=O)C1=C(C2=C(C=CC(=C2)C)C(=O)N1C)C3=CC=CC=C3Cl.CO | [C][C][C][C][C][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl].[C][O] |
CCCCCCC(C=O)C1=C(C2=C(C=CC(=C2)C)C(=O)N1C)C3=CC=CC=C3Cl | [C][C][C][C][C][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl] |
CCCC(C=O)C1=C(C2=C(C=CC(=C2)C)C(=O)N1C)C3=C(C=C(C=C3)OC)C.CO | [C][C][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][Branch1][O][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C].[C][O] |
CCCC(C=O)C1=C(C2=C(C=CC(=C2)C)C(=O)N1C)C3=C(C=C(C=C3)OC)C | [C][C][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][Branch1][O][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C] |
CC1=CC2=C(C=C1)C(=C(N(C2=O)C)CC=O)C3=C(C(=C(C=C3)OC)F)F.CC(C)(C)O.C#C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][Branch1][=C][C][=Branch1][#Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][F][F].[C][C][Branch1][C][C][Branch1][C][C][O].[C][#C] |
CC1=CC2=C(C=C1)C(=C(N(C2=O)C)CC=O)C3=C(C(=C(C=C3)OC)F)F | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][Branch1][=C][C][=Branch1][#Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][F][F] |
CCCC1=C(C=CC(=C1)C2=C(N(C(=O)C3=C2C=CC(=C3)C)C)CC=O)OC.CC(C)(C)O.C#C | [C][C][C][C][=C][Branch2][Ring2][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][C][=O][O][C].[C][C][Branch1][C][C][Branch1][C][C][O].[C][#C] |
CCCC1=C(C=CC(=C1)C2=C(N(C(=O)C3=C2C=CC(=C3)C)C)CC=O)OC | [C][C][C][C][=C][Branch2][Ring2][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][C][=O][O][C] |
CC1=CC(=NC=C1C)N2C(=C(C(=C(C2=O)C)CC(=O)O)C3=CC4=C(C=C3)OCCC4)C.CC(C)(C)O | [C][C][=C][C][=Branch1][#Branch1][=N][C][=C][Ring1][=Branch1][C][N][C][=Branch2][Ring2][=Branch1][=C][Branch2][Ring1][C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][C].[C][C][Branch1][C][C][Branch1][C][C][O] |
CC1=CC(=NC=C1C)N2C(=C(C(=C(C2=O)C)CC(=O)O)C3=CC4=C(C=C3)OCCC4)C | [C][C][=C][C][=Branch1][#Branch1][=N][C][=C][Ring1][=Branch1][C][N][C][=Branch2][Ring2][=Branch1][=C][Branch2][Ring1][C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][C] |
CC1=C(N(C(=C(C1=O)C2=CC3=C(C=C2)N=CN3)C)C4CCNCC4)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring2][Branch2][N][Branch2][Ring1][N][C][=Branch2][Ring1][#Branch1][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][=C][N][Ring1][#Branch1][C][C][C][C][N][C][C][Ring1][=Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CC1=C(C(=C(N(C1=O)C2=CC=CC=C2)C)C3=CC=CC=C3)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring1][S][C][=Branch2][Ring1][Ring2][=C][Branch1][S][N][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CC1=C2C(=CC=C1)C(=C(N(C2=O)C)CC(=O)O)C3=CC4=C(C=C3)OCCC4.CC(C)(C)O.C#C | [C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][=Branch2][Ring1][C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][=Branch2][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2].[C][C][Branch1][C][C][Branch1][C][C][O].[C][#C] |
CC1=C2C(=CC=C1)C(=C(N(C2=O)C)CC(=O)O)C3=CC4=C(C=C3)OCCC4 | [C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][=Branch2][Ring1][C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][=Branch2][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2] |
CC(C)OCCC(C1=C(C(=C(C(=O)N1C)C=C)C=C)C2=CC=CC=C2O)C(=O)O | [C][C][Branch1][C][C][O][C][C][C][Branch2][Ring1][P][C][=C][Branch2][Ring1][Ring1][C][=Branch1][=C][=C][Branch1][=Branch2][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=Branch1][C][=O][O] |
CC/C=C\C(=C/C)\C1=CC=C(C=C1)/C(=C\N(C)C(=O)C)/C2=C(C3=C(CCCO3)C=C2)Cl.C[C@H](C=O)OC(C)(C)C.CO | [C][C][/C][=C][\C][=Branch1][Ring1][=C][/C][\C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][/C][=Branch1][O][=C][\N][Branch1][C][C][C][=Branch1][C][=O][C][/C][=C][Branch1][#C][C][=C][Branch1][#Branch1][C][C][C][O][Ring1][=Branch1][C][=C][Ring1][#Branch2][Cl].[C][C@H1][Branch1][Ring1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C].[C][O] |
CC/C=C\C(=C/C)\C1=CC=C(C=C1)/C(=C\N(C)C(=O)C)/C2=C(C3=C(CCCO3)C=C2)Cl | [C][C][/C][=C][\C][=Branch1][Ring1][=C][/C][\C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][/C][=Branch1][O][=C][\N][Branch1][C][C][C][=Branch1][C][=O][C][/C][=C][Branch1][#C][C][=C][Branch1][#Branch1][C][C][C][O][Ring1][=Branch1][C][=C][Ring1][#Branch2][Cl] |
CC(C)(C)O.CN1C(=C(C2=C(C1=O)C=C(C=C2)F)C3=CC=C(C=C3)Cl)CC=O.CO.C#C | [C][C][Branch1][C][C][Branch1][C][C][O].[C][N][C][=Branch2][Ring1][P][=C][Branch2][Ring1][C][C][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][Branch1][Branch1][C][=C][Ring1][Branch2][F][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][=O].[C][O].[C][#C] |
CN1C(=C(C2=C(C1=O)C=C(C=C2)F)C3=CC=C(C=C3)Cl)CC=O | [C][N][C][=Branch2][Ring1][P][=C][Branch2][Ring1][C][C][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][Branch1][Branch1][C][=C][Ring1][Branch2][F][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][=O] |
CC(=O)N(C)/C(=C(/C1=CC2=C(C=C1)OCCC2(F)F)\C(=C\C=C)\C=C)/CC=O.CC(C)(C)O.CO.C#C | [C][C][=Branch1][C][=O][N][Branch1][C][C][/C][=Branch2][Ring1][P][=C][Branch2][Ring1][Branch1][/C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][Branch1][C][F][F][\C][=Branch1][Ring2][=C][\C][=C][\C][=C][/C][C][=O].[C][C][Branch1][C][C][Branch1][C][C][O].[C][O].[C][#C] |
CC(=O)N(C)/C(=C(/C1=CC2=C(C=C1)OCCC2(F)F)\C(=C\C=C)\C=C)/CC=O | [C][C][=Branch1][C][=O][N][Branch1][C][C][/C][=Branch2][Ring1][P][=C][Branch2][Ring1][Branch1][/C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][Branch1][C][F][F][\C][=Branch1][Ring2][=C][\C][=C][\C][=C][/C][C][=O] |
CC1=C(C=C(C=C1)C2=C(N(C(=C(C2=O)C)C(C(=O)O)OC(C)(C)C)C3CCNCC3)C)C | [C][C][=C][Branch2][Branch1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring2][=Branch2][N][Branch2][Ring1][=N][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][C][N][C][C][Ring1][=Branch1][C][C] |
CC(C)(C)O.CN1C(=C(C2=CC=CC=C2C1=O)C3=C(C(=C(C=C3)C4CC4)F)Cl)CC=O.CO.C#C | [C][C][Branch1][C][C][Branch1][C][C][O].[C][N][C][=Branch2][Ring2][Branch1][=C][Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][Branch1][P][C][=Branch1][=N][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][F][Cl][C][C][=O].[C][O].[C][#C] |
CN1C(=C(C2=CC=CC=C2C1=O)C3=C(C(=C(C=C3)C4CC4)F)Cl)CC=O | [C][N][C][=Branch2][Ring2][Branch1][=C][Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][Branch1][P][C][=Branch1][=N][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][F][Cl][C][C][=O] |
CCC1=CC=C(C=C1)C2=C(N(C(=O)C3=C2C=C(C=C3)Cl)C)CC=O.CC(C)(C)O.CO.C#C | [C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][C][=O].[C][C][Branch1][C][C][Branch1][C][C][O].[C][O].[C][#C] |
CCC1=CC=C(C=C1)C2=C(N(C(=O)C3=C2C=C(C=C3)Cl)C)CC=O | [C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][C][=O] |
CC1=C(C(=O)N(C(=C1C2=C(C3=C(C=C2)OCCN3)Cl)CC(=O)O)C)C(=O)NCC4CCCC4 | [C][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][Branch2][Ring1][P][C][=Branch2][Ring1][#Branch1][=C][Ring1][#Branch1][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][Branch1] |
CC1=C(C(=O)N(C(=C1C2=CC=C(C=C2)Cl)CC(=O)O)C)NC(=O)C(C)(C)C | [C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch2][Ring1][Branch2][C][=Branch1][#C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][=Branch1][C][=O][O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C] |
CC1=C(C(=O)N(C(=C1C2=CC3=C(C=C2)OCCN3CC(C)(C)[O-])CC(=O)O)C)C4=CC5=CC=CC=C5O4 | [C][C][=C][Branch2][Ring2][S][C][=Branch1][C][=O][N][Branch2][Ring2][#Branch1][C][=Branch2][Ring1][=N][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][C][C][Branch1][C][C][Branch1][C][C][O-1][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2] |
CC1=C(C(=O)N(C(=C1C2=CC3=C(C=C2)OCCN3CC(C)(C)O)CC(=O)O)C)C4=CC5=CC=CC=C5O4 | [C][C][=C][Branch2][Ring2][S][C][=Branch1][C][=O][N][Branch2][Ring2][#Branch1][C][=Branch2][Ring1][=N][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][C][C][Branch1][C][C][Branch1][C][C][O][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=C(C=C4C(=C3)CCCO4)F)CC=O)C.CC(C)(C)O.CO.C#C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][=C][C][=Branch2][Ring1][#Branch1][=C][Ring1][=Branch2][C][=C][Branch1][#C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][O][Ring1][#Branch1][F][C][C][=O][C].[C][C][Branch1][C][C][Branch1][C][C][O].[C][O].[C][#C] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=C(C=C4C(=C3)CCCO4)F)CC=O)C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][=C][C][=Branch2][Ring1][#Branch1][=C][Ring1][=Branch2][C][=C][Branch1][#C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][O][Ring1][#Branch1][F][C][C][=O][C] |
CCC1=CC=C(C=C1)C2=C(N(C(=O)C3=C2C=C(C=C3)C)C)C(COC(C)(C)CCl)C=O.CO | [C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][Branch1][N][C][O][C][Branch1][C][C][Branch1][C][C][C][Cl][C][=O].[C][O] |
CCC1=CC=C(C=C1)C2=C(N(C(=O)C3=C2C=C(C=C3)C)C)C(COC(C)(C)CCl)C=O | [C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][Branch1][N][C][O][C][Branch1][C][C][Branch1][C][C][C][Cl][C][=O] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC(=C4C(=C3Cl)CCCO4)F)CC=O)C.CC(C)(C)O.C#C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][#C][C][=Branch2][Ring1][Branch2][=C][Ring1][=Branch2][C][=C][C][=Branch1][#C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][Cl][C][C][C][O][Ring1][Branch2][F][C][C][=O][C].[C][C][Branch1][C][C][Branch1][C][C][O].[C][#C] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC(=C4C(=C3Cl)CCCO4)F)CC=O)C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][#C][C][=Branch2][Ring1][Branch2][=C][Ring1][=Branch2][C][=C][C][=Branch1][#C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][Cl][C][C][C][O][Ring1][Branch2][F][C][C][=O][C] |
CC1=C(C=C(C=C1)C2=C(N(C(=O)C(=C2C(C(=O)O)OC(C)(C)C)C(=O)NC3=CC=CC=C3)C4=CC(=C(C=C4)C)C)C)C | [C][C][=C][Branch2][=Branch1][#Branch2][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Branch1][N][N][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][C][=Branch2][Ring1][Branch1][=C][Ring1][#Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][C] |
CC1=CC2=C(C=C1)C(=C(N(C2=O)C)CC=O)C3=C4C(=C(C=C3)Cl)C=CC=N4.CC(C)(C)O.CO.C#C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][=C][C][=N][Ring1][#Branch2].[C][C][Branch1][C][C][Branch1][C][C][O].[C][O].[C][#C] |
CC1=CC2=C(C=C1)C(=C(N(C2=O)C)CC=O)C3=C4C(=C(C=C3)Cl)C=CC=N4 | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][=C][C][=N][Ring1][#Branch2] |
CC1=C(C=CC(=C1F)Br)/C(=C(\CC=O)/N(C)C(=O)C)/C(=C/C=C)/C=C.CC(C)(C)O.CO.C#C | [C][C][=C][Branch1][O][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][F][Br][/C][=Branch1][S][=C][Branch1][Ring2][\C][C][=O][/N][Branch1][C][C][C][=Branch1][C][=O][C][/C][=Branch1][Ring2][=C][/C][=C][/C][=C].[C][C][Branch1][C][C][Branch1][C][C][O].[C][O].[C][#C] |
CC1=C(C=CC(=C1F)Br)/C(=C(\CC=O)/N(C)C(=O)C)/C(=C/C=C)/C=C | [C][C][=C][Branch1][O][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][F][Br][/C][=Branch1][S][=C][Branch1][Ring2][\C][C][=O][/N][Branch1][C][C][C][=Branch1][C][=O][C][/C][=Branch1][Ring2][=C][/C][=C][/C][=C] |
CC1=NC=C(C=C1)NC(=O)C2=C(C(=C(N(C2=O)C)CC(=O)O)C3=CC4=C(C=C3)OCCN4CC(C)(C)[O-])C | [C][C][=N][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][Branch2][Ring2][#C][C][=Branch2][Ring1][C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][C][C][Branch1][C][C][Branch1][C][C][O-1][C] |
CC1=NC=C(C=C1)NC(=O)C2=C(C(=C(N(C2=O)C)CC(=O)O)C3=CC4=C(C=C3)OCCN4CC(C)(C)O)C | [C][C][=N][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][Branch2][Ring2][#C][C][=Branch2][Ring1][C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][C][C][Branch1][C][C][Branch1][C][C][O][C] |
CC1=C(N(C(=C(C1=O)C2=CC=CC=C2)C)C3CCNCC3)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring1][S][N][Branch2][Ring1][Ring2][C][=Branch1][S][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][N][C][C][Ring1][=Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CC.CC(=C)/C(=C\1/CCOC1=C)/C | [C][C].[C][C][=Branch1][C][=C][/C][=Branch1][=Branch2][=C][/C][C][O][C][\-Ring1][Branch1][=C][/C] |
CC(=C)/C(=C\1/CCOC1=C)/C | [C][C][=Branch1][C][=C][/C][=Branch1][=Branch2][=C][/C][C][O][C][\-Ring1][Branch1][=C][/C] |
CN1C(=C(C2=CC=CC=C2C1=O)C3=CC4=C(CCCC4(F)F)C=C3)CC(=O)O | [C][N][C][=Branch2][Ring2][Ring2][=C][Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Branch1][O][C][C][C][C][Ring1][=Branch1][Branch1][C][F][F][C][=C][Ring1][N][C][C][=Branch1][C][=O][O] |
CC1=C(C(=O)N(C(=C1C2=C(C3=C(C=C2)OCCC3)OC(C)(C)C)CC(=O)O)C)C4=CC=CC(=C4)C5=CC(=CN=C5)F | [C][C][=C][Branch2][Branch1][C][C][=Branch1][C][=O][N][Branch2][Ring2][=Branch2][C][=Branch2][Ring1][#C][=C][Ring1][#Branch1][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=C][C][=Branch1][=Branch1][=C][N][=C][Ring1][=Branch1][F] |
CC1=C(C=CC2=C1NCCO2)C3=C(N(C(=O)C(=C3C)C(=O)NCC(C)(C)C)C)CC(=O)O | [C][C][=C][Branch1][=N][C][=C][C][=C][Ring1][=Branch1][N][C][C][O][Ring1][=Branch1][C][=C][Branch2][Ring1][#C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][=Branch1][Branch1][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][=Branch1][C][=O][O] |
CCC1CCC(CC1)NC(=O)C2=C(C(=C(N(C2=O)C)CC(=O)O)C3=CC(=C(C=C3)OC)C)C | [C][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][Branch2][Ring2][Branch1][C][=Branch2][Ring1][C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=Branch1][#Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C] |
CC(C)(C)O[C@@H](C=O)C1=C(C2=C(C=C(C=C2)CC3=CC=CC=C3)C(=O)N1C)C4=C(C5=C(C=C4)OCCN5)Cl.CO | [C][C][Branch1][C][C][Branch1][C][C][O][C@@H1][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][S][C][=C][Branch2][Ring1][C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring2][Ring1][C][C][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl].[C][O] |
CC(C)(C)O[C@@H](C=O)C1=C(C2=C(C=C(C=C2)CC3=CC=CC=C3)C(=O)N1C)C4=C(C5=C(C=C4)OCCN5)Cl | [C][C][Branch1][C][C][Branch1][C][C][O][C@@H1][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][S][C][=C][Branch2][Ring1][C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring2][Ring1][C][C][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl] |
CC1=CC=C(C=C1)C2=C(N(C(=O)C(=C2C(CC(C)(C)C)C(=O)O)C(=O)N)C3=CC(=C(C=C3)C)C)C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Branch1][Ring2][N][Branch2][Ring2][C][C][=Branch1][C][=O][C][=Branch2][Ring1][Branch1][=C][Ring1][#Branch1][C][Branch1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C][=C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C] |
CC1=C(C=C(C=C1)C2=C(N(C(=C(C2=O)C)C(C(=O)O)OC(C)(C)C)C3=CC4=C(C=C3)OCCC4)C)C | [C][C][=C][Branch2][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring2][P][N][Branch2][Ring1][=N][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][C][C] |
CC1=CC2=C(C=C1)C(=C(N(C2=O)C)CC=O)C3=C4C(=C(C=C3)F)C(=CC=N4)C.CC(C)(C)O.CO.C#C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][F][C][=Branch1][=Branch1][=C][C][=N][Ring1][#Branch2][C].[C][C][Branch1][C][C][Branch1][C][C][O].[C][O].[C][#C] |
CC1=CC2=C(C=C1)C(=C(N(C2=O)C)CC=O)C3=C4C(=C(C=C3)F)C(=CC=N4)C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][F][C][=Branch1][=Branch1][=C][C][=N][Ring1][#Branch2][C] |
CC1=C(C=CC(=C1)Cl)C2C(N(C(=O)C3=C2C=C(C=C3)Cl)C)C(C(=O)O)OC(C)C | [C][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][Cl][C][C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][C] |
CC(C)O[C@@H](C1=C(C2=CC=CC=C2C(=O)N1C)C3=C4C5=C(C=C3)OCCC5=CC=N4)C(=O)O | [C][C][Branch1][C][C][O][C@@H1][Branch2][Ring2][#Branch2][C][=C][Branch1][P][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][=C][C][=N][Ring1][N][C][=Branch1][C][=O][O] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC4=C(C=C3)OC=C4)C(C)OC)C.CO | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][=N][C][=Branch2][Ring1][Ring1][=C][Ring1][=Branch2][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][=C][Ring1][#Branch1][C][Branch1][C][C][O][C][C].[C][O] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC4=C(C=C3)OC=C4)C(C)OC)C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][=N][C][=Branch2][Ring1][Ring1][=C][Ring1][=Branch2][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][=C][Ring1][#Branch1][C][Branch1][C][C][O][C][C] |
CC(C)(C)O[C@@H](C=O)C1=C(C2=C(C(=CC=C2)C3=CNN=C3)C(=O)N1C)C4=C(C(=C(C=C4)Br)F)Cl.CO | [C][C][Branch1][C][C][Branch1][C][C][O][C@@H1][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][N][C][=C][Branch1][S][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][=C][N][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][Ring1][S][C][C][=C][Branch1][=N][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Br][F][Cl].[C][O] |
CC(C)(C)O[C@@H](C=O)C1=C(C2=C(C(=CC=C2)C3=CNN=C3)C(=O)N1C)C4=C(C(=C(C=C4)Br)F)Cl | [C][C][Branch1][C][C][Branch1][C][C][O][C@@H1][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][N][C][=C][Branch1][S][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][=C][N][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][Ring1][S][C][C][=C][Branch1][=N][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Br][F][Cl] |
CC(C)(C)O[C@H](C1=C(C2=C(C=CC=C2F)C(=O)N1C)C3=C(C4=C(C=C3)OCCN4)Cl)C(=O)O | [C][C][Branch1][C][C][Branch1][C][C][O][C@H1][Branch2][Ring2][N][C][=C][Branch2][Ring1][Ring2][C][=C][Branch1][Branch2][C][=C][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl][C][=Branch1][C][=O][O] |
CCC1=CC=C(C=C1)C2=C(N(C(=O)C3=C2C=C(C=C3)Cl)C)C(C(=O)O)OC4CCC4 | [C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][C][C][C][Ring1][Ring2] |
CC1=C(C=CC(=C1)F)/C(=C(\CC=O)/N(C)C(=O)C)/C(=C/C=C)/C=C.CC(C)(C)O.CO.C#C | [C][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][F][/C][=Branch1][S][=C][Branch1][Ring2][\C][C][=O][/N][Branch1][C][C][C][=Branch1][C][=O][C][/C][=Branch1][Ring2][=C][/C][=C][/C][=C].[C][C][Branch1][C][C][Branch1][C][C][O].[C][O].[C][#C] |
CC1=C(C=CC(=C1)F)/C(=C(\CC=O)/N(C)C(=O)C)/C(=C/C=C)/C=C | [C][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][F][/C][=Branch1][S][=C][Branch1][Ring2][\C][C][=O][/N][Branch1][C][C][C][=Branch1][C][=O][C][/C][=Branch1][Ring2][=C][/C][=C][/C][=C] |
CC(C)(C)O.CN1CCN(CC1)CC2=CC3=C(C=C2)C(=C(N(C3=O)C)CC=O)C4=C(C5=C(C=C4)OCCN5)Cl.CO.C=C | [C][C][Branch1][C][C][Branch1][C][C][O].[C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl].[C][O].[C][=C] |
CN1CCN(CC1)CC2=CC3=C(C=C2)C(=C(N(C3=O)C)CC=O)C4=C(C5=C(C=C4)OCCN5)Cl | [C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][#C][=C][Branch1][=Branch2][N][Branch1][Branch1][C][Ring1][Branch2][=O][C][C][C][=O][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl] |
CC1=C(C=CC2=C1NCCO2)C3=C(N(C(=O)C(=C3C)C(=O)NC4(CCCC4)C)C)CC(=O)O | [C][C][=C][Branch1][=N][C][=C][C][=C][Ring1][=Branch1][N][C][C][O][Ring1][=Branch1][C][=C][Branch2][Ring1][S][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][=Branch1][Branch1][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CC1=C(C(=O)N(C(C1C2=C(C(=C(C=C2)Cl)F)OC(C)(C)C)CC(=O)O)C)C(=O)N[C@H]3CC34CCC(CC4)C#C | [C][C][=C][Branch2][Ring2][S][C][=Branch1][C][=O][N][Branch2][Ring2][#Branch1][C][Branch2][Ring1][=N][C][Ring1][#Branch1][C][=C][Branch1][=N][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][F][O][C][Branch1][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C@H1][C][C][Ring1][Ring1][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][#C] |
CC1=C(N(C(=C(C1=O)NC2=CC=CC=C2)C)C3=CC4=C(C=C3)OCCC4)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring2][=Branch2][N][Branch2][Ring1][Branch1][C][=Branch1][P][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CCCC(C=O)C1=C(C2=C(C=CC(=C2)C)C(=O)N1C)C3=CC=C(C=C3)C=C | [C][C][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C] |
CC#CCOCCC(C1=C(C2=C(C=CC(=C2)Br)C(=O)N1C)C3=CC=C(C=C3)Cl)C(=O)O | [C][C][#C][C][O][C][C][C][Branch2][Ring2][=Branch1][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][Br][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][=Branch1][C][=O][O] |
CC1=CC(=O)N(C(=C1)C(C(=O)OC)OC(C)(C)C)C | [C][C][=C][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch2][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][O][C][Branch1][C][C][Branch1][C][C][C][C] |
CC(C)(C)O.CN1C(=C(C(=C(C1=O)C(=C)OC)C=C)C2=CC=C(C=C2)Cl)NC=O.CO | [C][C][Branch1][C][C][Branch1][C][C][O].[C][N][C][=Branch2][Ring2][C][=C][Branch2][Ring1][Ring1][C][=Branch1][=C][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=Branch1][C][=C][O][C][C][=C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][N][C][=O].[C][O] |
CN1C(=C(C(=C(C1=O)C(=C)OC)C=C)C2=CC=C(C=C2)Cl)NC=O | [C][N][C][=Branch2][Ring2][C][=C][Branch2][Ring1][Ring1][C][=Branch1][=C][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=Branch1][C][=C][O][C][C][=C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][N][C][=O] |
CC(C)(C)OCC(C=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)C3=CC=C(C=C3)CCF.CO | [C][C][Branch1][C][C][Branch1][C][C][O][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][Cl][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][F].[C][O] |
CC(C)(C)OCC(C=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)C3=CC=C(C=C3)CCF | [C][C][Branch1][C][C][Branch1][C][C][O][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][Cl][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][F] |
CC1=C(C(=O)N(C(=C1C2=C3CCCN4C3=C(C=C2)OCC4)CC(=O)O)C)C(=O)NC5(CCCC5)C | [C][C][=C][Branch2][Ring2][N][C][=Branch1][C][=O][N][Branch2][Ring2][Ring1][C][=Branch2][Ring1][=Branch2][=C][Ring1][#Branch1][C][=C][C][C][C][N][C][Ring1][=Branch1][=C][Branch1][Branch1][C][=C][Ring1][#Branch2][O][C][C][Ring1][Branch2][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C] |
CC1=C(N(C(=C(C1=O)C2=CC=CC=C2)C)C3=CC4=C(C=C3)OCCC4)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring2][Branch2][N][Branch2][Ring1][Ring2][C][=Branch1][S][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=C(C=C3)CCF)CC=O)C.CC(C)(C)O.C#C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][=Branch1][P][=C][Ring1][=Branch2][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][F][C][C][=O][C].[C][C][Branch1][C][C][Branch1][C][C][O].[C][#C] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=C(C=C3)CCF)CC=O)C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][=Branch1][P][=C][Ring1][=Branch2][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][F][C][C][=O][C] |
CC1=C(N(C(=C(C1=O)C2=CC3=C(C=C2)N=CO3)C)C4=CC=C(C=C4)Cl)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring2][O][N][Branch2][Ring1][N][C][=Branch2][Ring1][#Branch1][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][=C][O][Ring1][#Branch1][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CC(C)(C)O[C@@H](C=O)C1=C(C2=C(C(=CC=C2)C3=CNN=C3)C(=O)N1C)C4=C(C5=C(C=C4)OCCN5)Cl.CO | [C][C][Branch1][C][C][Branch1][C][C][O][C@@H1][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][N][C][=C][Branch1][S][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][=C][N][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][Ring1][S][C][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl].[C][O] |
CC(C)(C)O[C@@H](C=O)C1=C(C2=C(C(=CC=C2)C3=CNN=C3)C(=O)N1C)C4=C(C5=C(C=C4)OCCN5)Cl | [C][C][Branch1][C][C][Branch1][C][C][O][C@@H1][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][N][C][=C][Branch1][S][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][=C][N][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][Ring1][S][C][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl] |
CC(C)(C)OCC(C=O)C1=C(C2=C(C=CC(=C2)OC)C(=O)N1C)C3=CC=C(C=C3)Cl.CO | [C][C][Branch1][C][C][Branch1][C][C][O][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][#Branch1][C][=C][Branch1][O][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][=Branch1][C][=O][N][Ring1][=N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl].[C][O] |
CC(C)(C)OCC(C=O)C1=C(C2=C(C=CC(=C2)OC)C(=O)N1C)C3=CC=C(C=C3)Cl | [C][C][Branch1][C][C][Branch1][C][C][O][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][#Branch1][C][=C][Branch1][O][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][=Branch1][C][=O][N][Ring1][=N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl] |
CC1=C(N(C(=C(C1=O)C2=CC=CC=C2)C)C3CCCCC3)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring1][S][N][Branch2][Ring1][Ring2][C][=Branch1][S][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][C][C][C][Ring1][=Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CCCC(C=O)C1=C(C2=C(C=CC(=C2)C)C(=O)N1)C3=CC=C(C=C3)Cl | [C][C][C][C][Branch1][Ring1][C][=O][C][=C][Branch2][Ring1][Branch1][C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring1][N][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl] |
CC.CC(=C)/C(=C/1\C(=C)OCCN1)/C | [C][C].[C][C][=Branch1][C][=C][/C][=Branch1][N][=C][\C][=Branch1][C][=C][O][C][C][N][/-Ring1][#Branch1][/C] |
CC1=C(C=C(C=C1)N2C(=CC(=O)C(=C2CO)C)C)C | [C][C][=C][Branch2][Ring1][N][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][C][=Branch1][#C][=C][C][=Branch1][C][=O][C][=Branch1][=Branch1][=C][Ring1][#Branch1][C][O][C][C][C] |
C[C@H](C=O)OC(C)(C)C.CN1C=C(C2=C(C1=O)C=C(C=C2)C3=CN=CN=C3)C4=C(C5=C(CCCO5)C=C4)Cl.CO | [C][C@H1][Branch1][Ring1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C].[C][N][C][=C][Branch2][Ring1][=Branch2][C][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][Branch1][Branch1][C][=C][Ring1][Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][=C][Branch1][#C][C][=C][Branch1][#Branch1][C][C][C][O][Ring1][=Branch1][C][=C][Ring1][#Branch2][Cl].[C][O] |
CN1C=C(C2=C(C1=O)C=C(C=C2)C3=CN=CN=C3)C4=C(C5=C(CCCO5)C=C4)Cl | [C][N][C][=C][Branch2][Ring1][=Branch2][C][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][Branch1][Branch1][C][=C][Ring1][Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][=C][Branch1][#C][C][=C][Branch1][#Branch1][C][C][C][O][Ring1][=Branch1][C][=C][Ring1][#Branch2][Cl] |
CC1=C(C(=O)N(C(=C1C2=C(C3=C(C=C2)OCCN3)Cl)CC(=O)O)C)C(=O)NC4(CC4)C(C)C | [C][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][Branch2][Ring1][P][C][=Branch2][Ring1][#Branch1][=C][Ring1][#Branch1][C][=C][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][Cl][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Branch1][C][C][C] |
CC1=C(N(C(=C(C1=O)NC2=CC=CC=C2)C)C3=CC=C(C=C3)C(F)(F)F)C(C(=O)O)OC(C)(C)C | [C][C][=C][Branch2][Ring2][O][N][Branch2][Ring1][Branch1][C][=Branch1][P][=C][Branch1][Branch1][C][Ring1][=Branch1][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C] |
CC1=C(C(=O)N(C(=C1C2=CC3=C(C=C2)OCCN3C(C)C(C)(C)O)CC(=O)O)C)C(=O)NC4CCCCCC4 | [C][C][=C][Branch2][Branch1][Ring1][C][=Branch1][C][=O][N][Branch2][Ring2][#Branch2][C][=Branch2][Ring1][S][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][Branch2][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][Ring1][#Branch1] |
CCO.CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=C(C=C3)OC)CC=O)C.CO.C#C | [C][C][O].[C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch1][C][=Branch1][S][=C][Ring1][=Branch2][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][=O][C].[C][O].[C][#C] |
CC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=C(C=C3)OC)CC=O)C | [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch1][C][=Branch1][S][=C][Ring1][=Branch2][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][C][=O][C] |
CC1=C(C=C(C=C1)N2C(=C(C(=O)C(=C2C(C(=O)O)OC(C)(C)C)C)C3=CC4=C(C=C3)N=CS4)C)C | [C][C][=C][Branch2][Branch1][#C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][C][=Branch2][Ring2][P][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][C][=Branch2][Ring1][Branch1][=C][Ring1][#Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][=C][S][Ring1][#Branch1][C][C] |
CC1=CC(=CC=C1)C2=C(N(C(=O)C3=C2C=C(C=C3)C)C)C(C=O)OC(C)C | [C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][Branch1][Ring1][C][=O][O][C][Branch1][C][C][C] |