| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C(Nc1ccccc1)Nc3cc2ccc(C(=[N@H])N)cc2cc3 |
| InChI | InChI | 1.03 | InChI=1S/C18H16N4O/c19-17(20)14-7-6-13-11-16(9-8-12(13)10-14)22-18(23)21-15-4-2-1-3-5-15/h1-11H,(H3,19,20)(H2,21,22,23) |
| InChIKey | InChI | 1.03 | JSKAQIFORULOPI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | NC(=N)c1ccc2cc(NC(=O)Nc3ccccc3)ccc2c1 |
| SMILES | CACTVS | 3.370 | NC(=N)c1ccc2cc(NC(=O)Nc3ccccc3)ccc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | [H]/N=C(/c1ccc2cc(ccc2c1)NC(=O)Nc3ccccc3)\N |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)NC(=O)Nc2ccc3cc(ccc3c2)C(=N)N |
