HRID669388

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13396

Benzonitrile, 4-amino-

C7H6N2

结构：COc1ccc(COc2cc(Br)cc(-c3cccc4c3ccn4[Si](C(C)C)(C(C)C)C(C)C)c2)cc1

HCID50993867

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(COc2cc(Nc3ccc(C#N)cc3)cc(-c3cccc4c3ccn4[Si](C(C)C)(C(C)C)C(C)C)c2)cc1

HCID68843219

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-25be6b63ae6b4415a89e87c3d283d089
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:1][c:2]1[cH:3][c:4](-[c:18]2[c:19]3[cH:20][cH:21][n:22]([Si:27]([CH:28]([CH3:29])[CH3:30])([CH:31]([CH3:32])[CH3:33])[CH:34]([CH3:35])[CH3:36])[c:23]3[cH:24][cH:25][cH:26]2)[cH:5][c:6]([O:8][CH2:9][c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[cH:7]1.[NH2:37][c:38]1[cH:39][cH:40][c:41]([C:42]#[N:43])[cH:44][cH:45]1>>[c:2]1([NH:37][c:38]2[cH:39][cH:40][c:41]([C:42]#[N:43])[cH:44][cH:45]2)[cH:3][c:4](-[c:18]2[c:19]3[cH:20][cH:21][n:22]([Si:27]([CH:28]([CH3:29])[CH3:30])([CH:31]([CH3:32])[CH3:33])[CH:34]([CH3:35])[CH3:36])[c:23]3[cH:24][cH:25][cH:26]2)[cH:5][c:6]([O:8][CH2:9][c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[cH:7]1