| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=S(=O)(N)c3ccc(Nc1nc(c(s1)C(=O)c2cccc(OC)c2)N)cc3 |
| SMILES_CANONICAL | CACTVS | 3.370 | COc1cccc(c1)C(=O)c2sc(Nc3ccc(cc3)[S](N)(=O)=O)nc2N |
| SMILES | CACTVS | 3.370 | COc1cccc(c1)C(=O)c2sc(Nc3ccc(cc3)[S](N)(=O)=O)nc2N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COc1cccc(c1)C(=O)c2c(nc(s2)Nc3ccc(cc3)S(=O)(=O)N)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | COc1cccc(c1)C(=O)c2c(nc(s2)Nc3ccc(cc3)S(=O)(=O)N)N |
| InChI | InChI | 1.03 | InChI=1S/C17H16N4O4S2/c1-25-12-4-2-3-10(9-12)14(22)15-16(18)21-17(26-15)20-11-5-7-13(8-6-11)27(19,23)24/h2-9H,18H2,1H3,(H,20,21)(H2,19,23,24) |
| InChIKey | InChI | 1.03 | WGWGFHMTAVZKKS-UHFFFAOYSA-N |
