HRID819782

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

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID10877907

未命名化合物

HCID53400832

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

C8H8N2O2

PRODUCTS

生成物

结构：Cc1c(CN(C)C(=O)C=Cc2ccc(N)nc2)c2ccccc2n1C

HCID66780868

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-57477f628ae440bab9ee03773b0284f5
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:45]([Cl:46])[CH2:47][Cl:48].[CH3:1][n:2]1[c:3]([CH3:14])[c:4]([CH2:11][NH:12][CH3:13])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12.[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[Cl:54][CH2:55][Cl:56].[NH2:15][c:16]1[cH:17][cH:18][c:19]([CH:22]=[CH:23][C:24](=[O:25])[OH:26])[cH:20][n:21]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH2:44].[OH:34][n:35]1[c:36]2[c:37]([cH:38][cH:39][cH:40][cH:41]2)[n:42][n:43]1>>[CH3:1][n:2]1[c:3]([CH3:14])[c:4]([CH2:11][N:12]([CH3:13])[C:24]([CH:23]=[CH:22][c:19]2[cH:18][cH:17][c:16]([NH2:15])[n:21][cH:20]2)=[O:26])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12