| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2Nc1ccc(OC)cc1C26CC6c4ccc5c(\C=C\c3ccc(cc3)CN(C)C)nnc5c4 |
| InChI | InChI | 1.03 | InChI=1S/C29H28N4O2/c1-33(2)17-19-6-4-18(5-7-19)8-12-25-22-11-9-20(14-27(22)32-31-25)24-16-29(24)23-15-21(35-3)10-13-26(23)30-28(29)34/h4-15,24H,16-17H2,1-3H3,(H,30,34)(H,31,32)/b12-8+/t24-,29-/m0/s1 |
| InChIKey | InChI | 1.03 | DKVKUPRCFKTRIY-IRIFPNPLSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | COc1ccc2NC(=O)[C@@]3(C[C@H]3c4ccc5c([nH]nc5c4)/C=C/c6ccc(CN(C)C)cc6)c2c1 |
| SMILES | CACTVS | 3.370 | COc1ccc2NC(=O)[C]3(C[CH]3c4ccc5c([nH]nc5c4)C=Cc6ccc(CN(C)C)cc6)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN(C)Cc1ccc(cc1)/C=C/c2c3ccc(cc3n[nH]2)[C@@H]4C[C@]45c6cc(ccc6NC5=O)OC |
| SMILES | OpenEye OEToolkits | 1.7.6 | CN(C)Cc1ccc(cc1)C=Cc2c3ccc(cc3n[nH]2)C4CC45c6cc(ccc6NC5=O)OC |
