6I6
概要
| 表記: | aficamten |
| 別名: | ~{N}-[(1~{R})-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1~{H}-inden-1-yl]-1-methyl-pyrazole-4-carboxamide |
| 組成式: | C18 H19 N5 O2 |
| 電荷: | 0 |
| 化学式量: | 337.376 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 | ~{N}-[(1~{R})-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1~{H}-inden-1-yl]-1-methyl-pyrazole-4-carboxamide |
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/C18H19N5O2/c1-3-16-21-17(22-25-16)12-4-6-14-11(8-12)5-7-15(14)20-18(24)13-9-19-23(2)10-13/h4,6,8-10,15H,3,5,7H2,1-2H3,(H,20,24)/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | IOVAZWDIRCRMTM-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCc1onc(n1)c2ccc3[C@@H](CCc3c2)NC(=O)c4cnn(C)c4 |
| SMILES | CACTVS | 3.385 | CCc1onc(n1)c2ccc3[CH](CCc3c2)NC(=O)c4cnn(C)c4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCc1nc(no1)c2ccc3c(c2)CC[C@H]3NC(=O)c4cnn(c4)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCc1nc(no1)c2ccc3c(c2)CCC3NC(=O)c4cnn(c4)C |
