HRID2133409

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：COc1cccc(C(CO)CC(=O)NN=C(c2ccccc2)c2ccccc2)c1

HCID86592621

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(C(COS(C)(=O)=O)CC(=O)NN=C(c2ccccc2)c2ccccc2)c1

HCID86592622

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-37d5304657b748b2810217ac1dfcf211
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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