HRID308110

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID3803620

N,N-Dimethyl-1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine

C15H24BNO2

结构：COc1cccc(-c2nc3cc(Cl)ccc3c(=O)n2CC(=O)NC(C)C)c1

HCID68521726

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(-c2nc3cc(-c4cccc(CN(C)C)c4)ccc3c(=O)n2CC(=O)NC(C)C)c1

HCID59511799

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ebecfd9389b46c6b8ae3facd31b103f
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

[CH3:28][N:29]([CH2:30][c:31]1[cH:32][c:33]([B:37]2[O:38][C:39]([CH3:40])([CH3:41])[C:42]([CH3:43])([CH3:44])[O:45]2)[cH:34][cH:35][cH:36]1)[CH3:46].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6](=[O:27])[n:7]([CH2:20][C:21](=[O:22])[NH:23][CH:24]([CH3:25])[CH3:26])[c:8](-[c:12]3[cH:13][c:14]([O:18][CH3:19])[cH:15][cH:16][cH:17]3)[n:9][c:10]2[cH:11]1.[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH2:52]>>[c:2]1(-[c:33]2[cH:32][c:31]([CH2:30][N:29]([CH3:28])[CH3:46])[cH:36][cH:35][cH:34]2)[cH:3][cH:4][c:5]2[c:6](=[O:27])[n:7]([CH2:20][C:21](=[O:22])[NH:23][CH:24]([CH3:25])[CH3:26])[c:8](-[c:12]3[cH:13][c:14]([O:18][CH3:19])[cH:15][cH:16][cH:17]3)[n:9][c:10]2[cH:11]1