HRID165802

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID7036

Benzhydrylamine

C13H13N

HCID8471

Triethylamine

C6H15N

结构：CN=C1SCC(O)(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N1C

HCID22760490

未命名化合物

PRODUCTS

生成物

结构：CN=C1SCC(O)(c2ccc(Cl)c(S(=O)(=O)NC(c3ccccc3)c3ccccc3)c2)N1C

HCID54130220

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c623e48f2feb444cba7448f36bd579d6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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