HRID199080

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID27695

1-Methyl-1H-indole-2-carboxylic acid

C10H9NO2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID81531

Diisopropylethylamine

C8H19N

HCID2734620

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

C12H18BNO2

PRODUCTS

生成物

结构：Cn1c(C(=O)Nc2ccc(B3OC(C)(C)C(C)(C)O3)cc2)cc2ccccc21

HCID18450543

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-300bfa8ffcd8417f8e80404192ccecdc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:20][C:21]1([CH3:35])[O:22][B:23]([c:28]2[cH:29][cH:30][c:31]([NH2:32])[cH:33][cH:34]2)[O:24][C:25]1([CH3:26])[CH3:27].[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[CH3:7][n:8]1[c:9]([C:17](=[O:18])[OH:19])[cH:10][c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]12.[CH:36]([N:37]([CH:38]([CH3:39])[CH3:40])[CH2:41][CH3:42])([CH3:43])[CH3:44].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Cl:45][CH2:46][Cl:47]>>[CH3:7][n:8]1[c:9]([C:17](=[O:19])[NH:32][c:31]2[cH:30][cH:29][c:28]([B:23]3[O:22][C:21]([CH3:20])([CH3:35])[C:25]([CH3:26])([CH3:27])[O:24]3)[cH:34][cH:33]2)[cH:10][c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]12