HRID1124922

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID51358483

1-(5-Bromopyridin-2-yl)ethan-1-amine

C7H9BrN2

HCID66893040

未命名化合物

PRODUCTS

生成物

结构：Cc1oncc1-c1ccc(CC(=O)NC(C)c2ccc(Br)cn2)cc1

HCID91204965

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-46d6e1d1725f4a12aa8002077ec328d8
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

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