| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CN(C)c1nc(nc2ccc(Cl)cc21)CCC1CCN(C1)c1ncccc1 |
| InChI | InChI | 1.03 | InChI=1S/C21H24ClN5/c1-26(2)21-17-13-16(22)7-8-18(17)24-19(25-21)9-6-15-10-12-27(14-15)20-5-3-4-11-23-20/h3-5,7-8,11,13,15H,6,9-10,12,14H2,1-2H3 |
| InChIKey | InChI | 1.03 | CIILBFUZQKWWFQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)c1nc(CC[C@H]2CCN(C2)c3ccccn3)nc4ccc(Cl)cc14 |
| SMILES | CACTVS | 3.385 | CN(C)c1nc(CC[CH]2CCN(C2)c3ccccn3)nc4ccc(Cl)cc14 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)c1c2cc(ccc2nc(n1)CC[C@H]3CCN(C3)c4ccccn4)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)c1c2cc(ccc2nc(n1)CCC3CCN(C3)c4ccccn4)Cl |
