| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=S(=O)(N)c1ccc(cc1)Nc2nccc(n2)c3cnc4ccccn34 |
| SMILES_CANONICAL | CACTVS | 3.341 | N[S](=O)(=O)c1ccc(Nc2nccc(n2)c3cnc4ccccn34)cc1 |
| SMILES | CACTVS | 3.341 | N[S](=O)(=O)c1ccc(Nc2nccc(n2)c3cnc4ccccn34)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccn2c(c1)ncc2c3ccnc(n3)Nc4ccc(cc4)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccn2c(c1)ncc2c3ccnc(n3)Nc4ccc(cc4)S(=O)(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C17H14N6O2S/c18-26(24,25)13-6-4-12(5-7-13)21-17-19-9-8-14(22-17)15-11-20-16-3-1-2-10-23(15)16/h1-11H,(H2,18,24,25)(H,19,21,22) |
| InChIKey | InChI | 1.03 | NKORVPQBJCGYEC-UHFFFAOYSA-N |
