Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1c4cccc(c4C=C(N1)c2ccc(cc2)CN3CCC(N(C)C)CC3)C |
InChI | InChI | 1.03 | InChI=1S/C24H29N3O/c1-17-5-4-6-21-22(17)15-23(25-24(21)28)19-9-7-18(8-10-19)16-27-13-11-20(12-14-27)26(2)3/h4-10,15,20H,11-14,16H2,1-3H3,(H,25,28) |
InChIKey | InChI | 1.03 | ZAVBKFISCRSHAT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C1CCN(CC1)Cc2ccc(cc2)C3=Cc4c(C)cccc4C(=O)N3 |
SMILES | CACTVS | 3.385 | CN(C)C1CCN(CC1)Cc2ccc(cc2)C3=Cc4c(C)cccc4C(=O)N3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1cccc2c1C=C(NC2=O)c3ccc(cc3)CN4CCC(CC4)N(C)C |
SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cccc2c1C=C(NC2=O)c3ccc(cc3)CN4CCC(CC4)N(C)C |