| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C(Nc1nccc(c1)NC(=O)c2ccccc2Cl)C3CC3 |
| InChI | InChI | 1.03 | InChI=1S/C16H14ClN3O2/c17-13-4-2-1-3-12(13)16(22)19-11-7-8-18-14(9-11)20-15(21)10-5-6-10/h1-4,7-10H,5-6H2,(H2,18,19,20,21,22) |
| InChIKey | InChI | 1.03 | BZYFIAMMQPKLOE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccccc1C(=O)Nc2ccnc(NC(=O)C3CC3)c2 |
| SMILES | CACTVS | 3.385 | Clc1ccccc1C(=O)Nc2ccnc(NC(=O)C3CC3)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)C(=O)Nc2ccnc(c2)NC(=O)C3CC3)Cl |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)C(=O)Nc2ccnc(c2)NC(=O)C3CC3)Cl |
