HRID1124959

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2734354

(2-Fluorophenyl)boronato(2-)

C6H6BFO2

HCID6484655

4-[2-(dimethylamino)ethoxy]aniline

C10H16N2O

HCID66914618

未命名化合物

PRODUCTS

生成物

结构：CN(C)CCOc1ccc(NC(=O)c2ccc(-c3ccccc3F)c3nccnc23)cc1

HCID44515353

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ec2dd27c0db04ffcaed05057f75d383d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:1][N:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([NH2:12])[cH:10][cH:11]1)[CH3:13].[F:14][c:15]1[c:16](-[c:21]2[cH:22][cH:23][c:24]([C:31](=[O:32])[OH:33])[c:25]3[n:26][cH:27][cH:28][n:29][c:30]23)[cH:17][cH:18][cH:19][cH:20]1.[F:34][c:35]1[cH:36][cH:37][cH:38][cH:39][c:40]1[B:41]([OH:42])[OH:43]>>[CH3:1][N:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([NH:12][C:31]([c:24]2[cH:23][cH:22][c:21](-[c:16]3[c:15]([F:14])[cH:20][cH:19][cH:18][cH:17]3)[c:30]3[c:25]2[n:26][cH:27][cH:28][n:29]3)=[O:32])[cH:10][cH:11]1)[CH3:13]