HRID175170

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID2736911

2,5-Difluorobenzenesulfonyl chloride

C6H3ClF2O2S

结构：CC(C)(C)c1nc(-c2cccc(N)c2F)c(-c2ccnc(Cl)n2)s1

HCID57989845

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)c1nc(-c2cccc(NS(=O)(=O)c3cc(F)ccc3F)c2F)c(-c2ccnc(Cl)n2)s1

HCID44516823

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6428ccba6eac443ea1c289f79cdd40d4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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