HRID102379

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID2734273

2,4-Difluorobenzenesulfonyl chloride

C6H3ClF2O2S

结构：CC(C)c1nc(-c2ccc(F)c(N)c2)c(-c2ccnc(Cl)n2)s1

HCID57989785

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1nc(-c2ccc(F)c(NS(=O)(=O)c3ccc(F)cc3F)c2)c(-c2ccnc(Cl)n2)s1

HCID57989690

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ce272d84eae6406093da297cef4e6b40
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

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