SFW
概要
表記: | 1-[4-methyl-2-(trifluoromethyl)phenyl]-2-phenyl-imidazole |
組成式: | C17 H13 F3 N2 |
電荷: | 0 |
化学式量: | 302.294 Da |
分子種別: | non-polymer |
化合物名
プログラム | バージョン | 表記 |
OpenEye OEToolkits | 2.0.7 | 1-[4-methyl-2-(trifluoromethyl)phenyl]-2-phenyl-imidazole |
化合物記述子(線形表記)
種別 | プログラム | バージョン | 表記 |
InChI | InChI | 1.03 | InChI=1S/C17H13F3N2/c1-12-7-8-15(14(11-12)17(18,19)20)22-10-9-21-16(22)13-5-3-2-4-6-13/h2-11H,1H3 |
InChIKey | InChI | 1.03 | UBEVGQDCLDVUPA-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(n2ccnc2c3ccccc3)c(c1)C(F)(F)F |
SMILES | CACTVS | 3.385 | Cc1ccc(n2ccnc2c3ccccc3)c(c1)C(F)(F)F |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1)C(F)(F)F)n2ccnc2c3ccccc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1)C(F)(F)F)n2ccnc2c3ccccc3 |