| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C2C=C(N=C(SCC(=O)c1ccc(cc1)S(=O)(=O)N)N2)C |
| InChI | InChI | 1.03 | InChI=1S/C13H13N3O4S2/c1-8-6-12(18)16-13(15-8)21-7-11(17)9-2-4-10(5-3-9)22(14,19)20/h2-6H,7H2,1H3,(H2,14,19,20)(H,15,16,18) |
| InChIKey | InChI | 1.03 | UZGWPPSMIYIVBV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC1=CC(=O)NC(=N1)SCC(=O)c2ccc(cc2)[S](N)(=O)=O |
| SMILES | CACTVS | 3.370 | CC1=CC(=O)NC(=N1)SCC(=O)c2ccc(cc2)[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CC1=CC(=O)NC(=N1)SCC(=O)c2ccc(cc2)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 1.7.2 | CC1=CC(=O)NC(=N1)SCC(=O)c2ccc(cc2)S(=O)(=O)N |
