CK2
概要
| 表記: | 4-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)PYRIMIDIN-2-AMINE |
| 別名: | 4-(2,4-DIMETHYL-THIAZOL-5-YL)-PYRIMIDIN-2-YLAMINE |
| 組成式: | C9 H10 N4 S |
| 電荷: | 0 |
| 化学式量: | 206.267 Da |
| 分子種別: | NON-POLYMER |
化合物名
| プログラム | バージョン | 表記 |
| ACDLabs | 10.04 | 4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-amine |
| OpenEye OEToolkits | 1.5.0 | 4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-amine |
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 | 10.04 | n2c(c1sc(nc1C)C)ccnc2N |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1sc(c(C)n1)c2ccnc(N)n2 |
| SMILES | CACTVS | 3.341 | Cc1sc(c(C)n1)c2ccnc(N)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c(sc(n1)C)c2ccnc(n2)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c(sc(n1)C)c2ccnc(n2)N |
| InChI | InChI | 1.03 | InChI=1S/C9H10N4S/c1-5-8(14-6(2)12-5)7-3-4-11-9(10)13-7/h3-4H,1-2H3,(H2,10,11,13) |
| InChIKey | InChI | 1.03 | CTFDMGIBHFQWKB-UHFFFAOYSA-N |
