| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=S(=O)(NC(C)(C)C)c1ccc(cc1)c2cc3c(cccc3nc2)Nc4ncccc4 |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)(C)N[S](=O)(=O)c1ccc(cc1)c2cnc3cccc(Nc4ccccn4)c3c2 |
| SMILES | CACTVS | 3.341 | CC(C)(C)N[S](=O)(=O)c1ccc(cc1)c2cnc3cccc(Nc4ccccn4)c3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)(C)NS(=O)(=O)c1ccc(cc1)c2cc3c(cccc3Nc4ccccn4)nc2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)(C)NS(=O)(=O)c1ccc(cc1)c2cc3c(cccc3Nc4ccccn4)nc2 |
| InChI | InChI | 1.03 | InChI=1S/C24H24N4O2S/c1-24(2,3)28-31(29,30)19-12-10-17(11-13-19)18-15-20-21(26-16-18)7-6-8-22(20)27-23-9-4-5-14-25-23/h4-16,28H,1-3H3,(H,25,27) |
| InChIKey | InChI | 1.03 | GJTCKUKIFXWJKG-UHFFFAOYSA-N |
