VOQ
概要
| 表記: | N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,2-dimethyl-L-alaninamide |
| 組成式: | C11 H19 N3 O2 |
| 電荷: | 0 |
| 化学式量: | 225.287 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-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,2-dimethyl-L-alaninamide |
| OpenEye OEToolkits | 2.0.7 | 2-azanyl-~{N}-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-~{N},2-dimethyl-propanamide |
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 | CN(Cc1c(C)onc1C)C(=O)C(C)(C)N |
| InChI | InChI | 1.06 | InChI=1S/C11H19N3O2/c1-7-9(8(2)16-13-7)6-14(5)10(15)11(3,4)12/h6,12H2,1-5H3 |
| InChIKey | InChI | 1.06 | RELIAECMPOCXRD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(Cc1c(C)onc1C)C(=O)C(C)(C)N |
| SMILES | CACTVS | 3.385 | CN(Cc1c(C)onc1C)C(=O)C(C)(C)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(c(on1)C)CN(C)C(=O)C(C)(C)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(c(on1)C)CN(C)C(=O)C(C)(C)N |
