| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O=C(N1CCCC1)CN5CCN(c4ncnc(c3sc2ccccc2c3)c4)CC5 |
| SMILES_CANONICAL | CACTVS | 3.352 | O=C(CN1CCN(CC1)c2cc(ncn2)c3sc4ccccc4c3)N5CCCC5 |
| SMILES | CACTVS | 3.352 | O=C(CN1CCN(CC1)c2cc(ncn2)c3sc4ccccc4c3)N5CCCC5 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc2c(c1)cc(s2)c3cc(ncn3)N4CCN(CC4)CC(=O)N5CCCC5 |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc2c(c1)cc(s2)c3cc(ncn3)N4CCN(CC4)CC(=O)N5CCCC5 |
| InChI | InChI | 1.03 | InChI=1S/C22H25N5OS/c28-22(27-7-3-4-8-27)15-25-9-11-26(12-10-25)21-14-18(23-16-24-21)20-13-17-5-1-2-6-19(17)29-20/h1-2,5-6,13-14,16H,3-4,7-12,15H2 |
| InChIKey | InChI | 1.03 | NDLZMZLRTHDNSQ-UHFFFAOYSA-N |
