WDH
概要
| 表記: | N,N~2~-diethyl-N~2~-(2-methylpyrimidin-4-yl)glycinamide |
| 組成式: | C11 H18 N4 O |
| 電荷: | 0 |
| 化学式量: | 222.287 Da |
| 分子種別: | non-polymer |
化合物名
| プログラム | バージョン | 表記 |
| ACDLabs | 12.01 | N,N~2~-diethyl-N~2~-(2-methylpyrimidin-4-yl)glycinamide |
| OpenEye OEToolkits | 2.0.7 | ~{N}-ethyl-2-[ethyl-(2-methylpyrimidin-4-yl)amino]ethanamide |
化合物記述子（線形表記）
| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | Cc1nc(ccn1)N(CC(=O)NCC)CC |
| InChI | InChI | 1.06 | InChI=1S/C11H18N4O/c1-4-12-11(16)8-15(5-2)10-6-7-13-9(3)14-10/h6-7H,4-5,8H2,1-3H3,(H,12,16) |
| InChIKey | InChI | 1.06 | WLGVAJHCCALAOC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCNC(=O)CN(CC)c1ccnc(C)n1 |
| SMILES | CACTVS | 3.385 | CCNC(=O)CN(CC)c1ccnc(C)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCNC(=O)CN(CC)c1ccnc(n1)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCNC(=O)CN(CC)c1ccnc(n1)C |
