| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=C(N(Cc1ccccc1)Cc2ccccc2)c3oc(nc3)N |
| SMILES_CANONICAL | CACTVS | 3.352 | Nc1oc(cn1)C(=O)N(Cc2ccccc2)Cc3ccccc3 |
| SMILES | CACTVS | 3.352 | Nc1oc(cn1)C(=O)N(Cc2ccccc2)Cc3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1ccc(cc1)CN(Cc2ccccc2)C(=O)c3cnc(o3)N |
| SMILES | OpenEye OEToolkits | 1.6.1 | c1ccc(cc1)CN(Cc2ccccc2)C(=O)c3cnc(o3)N |
| InChI | InChI | 1.03 | InChI=1S/C18H17N3O2/c19-18-20-11-16(23-18)17(22)21(12-14-7-3-1-4-8-14)13-15-9-5-2-6-10-15/h1-11H,12-13H2,(H2,19,20) |
| InChIKey | InChI | 1.03 | KIJXWOGFYAWTNC-UHFFFAOYSA-N |
