| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(N1CSCC1)C3NCC(CNC(=O)c2ncsc2)C3 |
| SMILES_CANONICAL | CACTVS | 3.341 | O=C(NC[C@@H]1CN[C@@H](C1)C(=O)N2CCSC2)c3cscn3 |
| SMILES | CACTVS | 3.341 | O=C(NC[CH]1CN[CH](C1)C(=O)N2CCSC2)c3cscn3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c(ncs1)C(=O)NC[C@H]2C[C@H](NC2)C(=O)N3CCSC3 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1c(ncs1)C(=O)NCC2CC(NC2)C(=O)N3CCSC3 |
| InChI | InChI | 1.03 | InChI=1S/C13H18N4O2S2/c18-12(11-6-21-7-16-11)15-5-9-3-10(14-4-9)13(19)17-1-2-20-8-17/h6-7,9-10,14H,1-5,8H2,(H,15,18)/t9-,10-/m0/s1 |
| InChIKey | InChI | 1.03 | KFQMVMSMRNCTET-UWVGGRQHSA-N |
