U0P
概要
| 表記: | N'-cyclopropyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]urea |
| 組成式: | C10 H15 N3 O2 |
| 電荷: | 0 |
| 化学式量: | 209.245 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'-cyclopropyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]urea |
| OpenEye OEToolkits | 2.0.7 | 3-cyclopropyl-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea |
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 | C(N(C)Cc1noc(c1)C)(NC2CC2)=O |
| InChI | InChI | 1.03 | InChI=1S/C10H15N3O2/c1-7-5-9(12-15-7)6-13(2)10(14)11-8-3-4-8/h5,8H,3-4,6H2,1-2H3,(H,11,14) |
| InChIKey | InChI | 1.03 | QKUCRJSBLDVNFL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(Cc1cc(C)on1)C(=O)NC2CC2 |
| SMILES | CACTVS | 3.385 | CN(Cc1cc(C)on1)C(=O)NC2CC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(no1)CN(C)C(=O)NC2CC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(no1)CN(C)C(=O)NC2CC2 |
