| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(=O)(N)c2cccc(C(=O)CSc1ncccn1)c2 |
| InChI | InChI | 1.03 | InChI=1S/C12H11N3O3S2/c13-20(17,18)10-4-1-3-9(7-10)11(16)8-19-12-14-5-2-6-15-12/h1-7H,8H2,(H2,13,17,18) |
| InChIKey | InChI | 1.03 | BWAZRCOFUQSGBG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | N[S](=O)(=O)c1cccc(c1)C(=O)CSc2ncccn2 |
| SMILES | CACTVS | 3.370 | N[S](=O)(=O)c1cccc(c1)C(=O)CSc2ncccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)S(=O)(=O)N)C(=O)CSc2ncccn2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)S(=O)(=O)N)C(=O)CSc2ncccn2 |
