HRID1216172

反应详情

EQUATION

反应方程式

REACTANTS

反应物

反应SMILES：FC(F)(F)c1cc(CBr)cc(C(F)(F)F)c1

HCID122573

3,5-Bis(trifluoromethyl)benzyl bromide

C9H5BrF6

反应SMILES：COc1ccc(C(C)C)cc1-c1ccc(C(F)(F)F)cc1C1CNC(=O)O1

HCID59135182

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(C(C)C)cc1-c1ccc(C(F)(F)F)cc1C1CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)O1

HCID11721382

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-84a44f90f2484779b3c8a1d1afe043db
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:26][CH3:27])[c:8](-[c:10]2[c:11]([CH:20]3[CH2:21][NH:22][C:23](=[O:25])[O:24]3)[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[cH:9]1.[F:28][C:29]([c:30]1[cH:31][c:32]([CH2:33][Br:34])[cH:35][c:36]([C:38]([F:39])([F:40])[F:41])[cH:37]1)([F:42])[F:43]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:26][CH3:27])[c:8](-[c:10]2[c:11]([CH:20]3[CH2:21][N:22]([CH2:33][c:32]4[cH:31][c:30]([C:29]([F:28])([F:42])[F:43])[cH:37][c:36]([C:38]([F:39])([F:40])[F:41])[cH:35]4)[C:23](=[O:25])[O:24]3)[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[cH:9]1