| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(N3CC(c2c1cccnc1nc2C)CC3)C5(c4ncccc4)CC5 |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1[nH]c2ncccc2c1[C@@H]3CCN(C3)C(=O)C4(CC4)c5ccccn5 |
| SMILES | CACTVS | 3.341 | Cc1[nH]c2ncccc2c1[CH]3CCN(C3)C(=O)C4(CC4)c5ccccn5 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c(c2cccnc2[nH]1)[C@@H]3CCN(C3)C(=O)C4(CC4)c5ccccn5 |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c(c2cccnc2[nH]1)C3CCN(C3)C(=O)C4(CC4)c5ccccn5 |
| InChI | InChI | 1.03 | InChI=1S/C21H22N4O/c1-14-18(16-5-4-11-23-19(16)24-14)15-7-12-25(13-15)20(26)21(8-9-21)17-6-2-3-10-22-17/h2-6,10-11,15H,7-9,12-13H2,1H3,(H,23,24)/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | HUWRMRPEILCPLL-OAHLLOKOSA-N |
