HRID100629

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2795193

5-Pyrimidinylboronic acid

C4H5BN2O2

HCID21980034

2,6-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

C13H20BNO2

HCID69231312

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-c2ccc3nc(C4CC(N5CCCC5C)C4)sc3c2)c(C)n1

HCID69202814

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-345bb6b535934439bb0701f4d188124b
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

[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]([CH:9]3[CH2:10][CH:11]([N:13]4[CH:14]([CH3:18])[CH2:15][CH2:16][CH2:17]4)[CH2:12]3)[s:8]2)[cH:19][cH:20]1.[CH3:21][c:22]1[n:23][c:24]([CH3:37])[cH:25][cH:26][c:27]1[B:28]1[O:29][C:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36]1.[n:38]1[cH:39][c:40]([B:41]([OH:42])[OH:43])[cH:44][n:45][cH:46]1>>[c:2]1(-[c:27]2[c:22]([CH3:21])[n:23][c:24]([CH3:37])[cH:25][cH:26]2)[cH:3][c:4]2[c:5]([n:6][c:7]([CH:9]3[CH2:10][CH:11]([N:13]4[CH:14]([CH3:18])[CH2:15][CH2:16][CH2:17]4)[CH2:12]3)[s:8]2)[cH:19][cH:20]1