HRID320139

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2734665

4-Fluoro-2-methylphenylboronic acid

C7H8BFO2

结构：CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(Cl)cc1-c1ccccc1Cl

HCID23502837

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(F)ccc1-c1cc(Cl)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID23502784

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3774fd56f4d64c52b3cc2b47608652dd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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