| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1NC(=O)SC1Cc3ccc(OCCN(c2ncccc2)C)cc3 |
| InChI | InChI | 1.03 | InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | YASAKCUCGLMORW-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CN(CCOc1ccc(C[C@H]2SC(=O)NC2=O)cc1)c3ccccn3 |
| SMILES | CACTVS | 3.370 | CN(CCOc1ccc(C[CH]2SC(=O)NC2=O)cc1)c3ccccn3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CN(CCOc1ccc(cc1)C[C@@H]2C(=O)NC(=O)S2)c3ccccn3 |
| SMILES | OpenEye OEToolkits | 1.7.2 | CN(CCOc1ccc(cc1)CC2C(=O)NC(=O)S2)c3ccccn3 |
