HRID944270

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID22139082

未命名化合物

HCID53400832

3-(6-Aminopyridin-3-yl)prop-2-enoic acid

C8H8N2O2

PRODUCTS

生成物

结构：CN(Cc1cc2c(Cl)cc(Cl)cc2n1C)C(=O)C=Cc1ccc(N)nc1

HCID66780792

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fec21dfa81bd45fa9183334e0ff00300
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:1]([Cl:2])[CH2:3][Cl:4].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:17][c:18]1[c:19]2[cH:20][c:21]([CH2:29][NH:30][CH3:31])[n:22]([CH3:28])[c:23]2[cH:24][c:25]([Cl:27])[cH:26]1.[NH2:5][c:6]1[cH:7][cH:8][c:9]([CH:12]=[CH:13][C:14](=[O:15])[OH:16])[cH:10][n:11]1.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH2:42].[OH:32][n:33]1[c:34]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[n:40][n:41]1>>[NH2:5][c:6]1[cH:7][cH:8][c:9]([CH:12]=[CH:13][C:14](=[O:16])[N:30]([CH2:29][c:21]2[cH:20][c:19]3[c:18]([Cl:17])[cH:26][c:25]([Cl:27])[cH:24][c:23]3[n:22]2[CH3:28])[CH3:31])[cH:10][n:11]1