HRID118437

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID62493

2,2-Dimethylpropanoyl chloride

C5H9ClO

结构：COc1cccc(C(Oc2cc3cnn(-c4ccc(F)cc4)c3cc2C)C(C)N)c1

HCID178490413

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(C(Oc2cc3cnn(-c4ccc(F)cc4)c3cc2C)C(C)NC(=O)C(C)(C)C)c1

HCID90803740

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e432f9fa8ec6423991744d5809571f2e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:31]([C:32]([CH3:33])([CH3:34])[CH3:35])(=[O:36])[Cl:37].[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]3[cH:12][c:13]([O:18][CH:19]([CH:20]([CH3:21])[NH2:22])[c:23]4[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][cH:28]4)[c:14]([CH3:17])[cH:15][c:16]23)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]3[cH:12][c:13]([O:18][CH:19]([CH:20]([CH3:21])[NH:22][C:31]([C:32]([CH3:33])([CH3:34])[CH3:35])=[O:36])[c:23]4[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][cH:28]4)[c:14]([CH3:17])[cH:15][c:16]23)[cH:6][cH:7]1