HRID91858

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID2760632

o-tolyl-acetyl chloride

C9H9ClO

HCID86757929

未命名化合物

PRODUCTS

产物

HCID86757928

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-43ef9f74100d415fa4ef772afd60b17b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

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