| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(C1CCCN1)(Nc4ccc(C(N2CC(C2)c3nccs3)=O)s4)=O |
| InChI | InChI | 1.03 | InChI=1S/C16H18N4O2S2/c21-14(11-2-1-5-17-11)19-13-4-3-12(24-13)16(22)20-8-10(9-20)15-18-6-7-23-15/h3-4,6-7,10-11,17H,1-2,5,8-9H2,(H,19,21)/t11-/m0/s1 |
| InChIKey | InChI | 1.03 | XXEFZFWFYAPRID-NSHDSACASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(Nc1sc(cc1)C(=O)N2CC(C2)c3sccn3)[C@@H]4CCCN4 |
| SMILES | CACTVS | 3.385 | O=C(Nc1sc(cc1)C(=O)N2CC(C2)c3sccn3)[CH]4CCCN4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(sc1C(=O)N2CC(C2)c3nccs3)NC(=O)[C@@H]4CCCN4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(sc1C(=O)N2CC(C2)c3nccs3)NC(=O)C4CCCN4 |
