L6O
概要
| 表記: | (5R)-N-(4-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine |
| 組成式: | C10 H11 F N2 S |
| 電荷: | 0 |
| 化学式量: | 210.271 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 | (5R)-N-(4-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine |
| OpenEye OEToolkits | 2.0.7 | (5~{R})-~{N}-(4-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-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 | 12.01 | CC1CN=C(Nc2ccc(F)cc2)S1 |
| InChI | InChI | 1.03 | InChI=1S/C10H11FN2S/c1-7-6-12-10(14-7)13-9-4-2-8(11)3-5-9/h2-5,7H,6H2,1H3,(H,12,13)/t7-/m1/s1 |
| InChIKey | InChI | 1.03 | QAZPKSKUOOWBMI-SSDOTTSWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H]1CN=C(Nc2ccc(F)cc2)S1 |
| SMILES | CACTVS | 3.385 | C[CH]1CN=C(Nc2ccc(F)cc2)S1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H]1CN=C(S1)Nc2ccc(cc2)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1CN=C(S1)Nc2ccc(cc2)F |
