HRID158939

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID46736783

3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-imidazo[4,5-b]pyridine

C13H18BN3O2

结构：Cc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(Br)cc3c21

HCID59619739

未命名化合物

PRODUCTS

生成物

结构：Cc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(-c4cnc5c(c4)ncn5C)cc3c21

HCID59620057

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b8bd07f6c32249d6b8cc1baa4aa39758
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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