HRID2347998

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID122573

3,5-Bis(trifluoromethyl)benzyl bromide

C9H5BrF6

结构：COc1ccc(C(C)C)cc1-c1ccc(C(F)(F)F)cc1C1OC(=O)NC1C

HCID66716899

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(C)C)cc1-c1ccc(C(F)(F)F)cc1C1OC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1C

HCID72987447

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2428ec6992ca467f899b26f3466dc5e8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:27][CH3:28])[c:8](-[c:10]2[c:11]([CH:20]3[CH:21]([CH3:26])[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:29][C:30]([c:31]1[cH:32][c:33]([CH2:34][Br:35])[cH:36][c:37]([C:39]([F:40])([F:41])[F:42])[cH:38]1)([F:43])[F:44]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:27][CH3:28])[c:8](-[c:10]2[c:11]([CH:20]3[CH:21]([CH3:26])[N:22]([CH2:34][c:33]4[cH:32][c:31]([C:30]([F:29])([F:43])[F:44])[cH:38][c:37]([C:39]([F:40])([F:41])[F:42])[cH:36]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