Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C24H26N4O/c1-18-7-5-6-10-20(18)16-27-13-14-28-22-11-12-26(15-19-8-3-2-4-9-19)17-21(22)23(29)25-24(27)28/h2-10H,11-17H2,1H3 |
InChIKey | InChI | 1.06 | CPQVAKZHOMXNHY-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccccc1CN2CCN3C4=C(CN(CC4)Cc5ccccc5)C(=O)N=C23 |
SMILES | CACTVS | 3.385 | Cc1ccccc1CN2CCN3C4=C(CN(CC4)Cc5ccccc5)C(=O)N=C23 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccccc1CN2CCN3C2=NC(=O)C4=C3CCN(C4)Cc5ccccc5 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccccc1CN2CCN3C2=NC(=O)C4=C3CCN(C4)Cc5ccccc5 |