HRID683235

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7498

alpha-Bromotoluene

C7H7Br

反应SMILES：COc1ccc(CN2C(=O)NCC2c2cc(C(F)(F)F)ccc2-c2cc(C(C)C)c(F)cc2OC)cc1

HCID59135248

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(CN2C(=O)N(Cc3ccccc3)CC2c2cc(C(F)(F)F)ccc2-c2cc(C(C)C)c(F)cc2OC)cc1

HCID66716974

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-c663dd9083524bcd8e63faa3f499098c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

[Br:38][CH2:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[F:1][c:2]1[cH:3][c:4]([O:36][CH3:37])[c:5](-[c:11]2[c:12]([CH:21]3[CH2:22][NH:23][C:24](=[O:35])[N:25]3[CH2:26][c:27]3[cH:28][cH:29][c:30]([O:33][CH3:34])[cH:31][cH:32]3)[cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]2)[cH:6][c:7]1[CH:8]([CH3:9])[CH3:10]>>[F:1][c:2]1[cH:3][c:4]([O:36][CH3:37])[c:5](-[c:11]2[c:12]([CH:21]3[CH2:22][N:23]([CH2:39][c:40]4[cH:41][cH:42][cH:43][cH:44][cH:45]4)[C:24](=[O:35])[N:25]3[CH2:26][c:27]3[cH:28][cH:29][c:30]([O:33][CH3:34])[cH:31][cH:32]3)[cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]2)[cH:6][c:7]1[CH:8]([CH3:9])[CH3:10]