EHH
概要
| 表記: | [3,5-dimethyl-4-(1-methyl-5-pyridin-4-yl-imidazol-4-yl)phenyl]methanamine |
| 組成式: | C18 H20 N4 |
| 電荷: | 0 |
| 化学式量: | 292.378 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 | 2.0.6 | [3,5-dimethyl-4-(1-methyl-5-pyridin-4-yl-imidazol-4-yl)phenyl]methanamine |
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/C18H20N4/c1-12-8-14(10-19)9-13(2)16(12)17-18(22(3)11-21-17)15-4-6-20-7-5-15/h4-9,11H,10,19H2,1-3H3 |
| InChIKey | InChI | 1.03 | LYFZPAXTPPYSEC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cnc(c1c2ccncc2)c3c(C)cc(CN)cc3C |
| SMILES | CACTVS | 3.385 | Cn1cnc(c1c2ccncc2)c3c(C)cc(CN)cc3C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cc(cc(c1c2c(n(cn2)C)c3ccncc3)C)CN |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(cc(c1c2c(n(cn2)C)c3ccncc3)C)CN |
