HRID1227735

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID12232

Methyl disulfide

C2H6S2

结构：CCc1cccc(C)c1S(=O)(=O)c1nn(C(=O)N(CC)CC)cc1Cl

HCID19932070

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：CCc1cccc(C)c1S(=O)(=O)c1nn(C(=O)N(CC)CC)c(SC)c1Cl

HCID19931846

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f66136dda4ff4ab88411eed6804ed266
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH3:31][S:32][S:33][CH3:34].[CH3:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42].[Cl-:35].[Cl:6][c:7]1[c:8]([S:19](=[O:20])(=[O:21])[c:22]2[c:23]([CH2:29][CH3:30])[cH:24][cH:25][cH:26][c:27]2[CH3:28])[n:9][n:10]([C:12]([N:13]([CH2:14][CH3:15])[CH2:16][CH3:17])=[O:18])[cH:11]1.[Li:1][CH2:2][CH2:3][CH2:4][CH3:5].[NH4+:36].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1>>[Cl:6][c:7]1[c:8]([S:19](=[O:20])(=[O:21])[c:22]2[c:23]([CH2:29][CH3:30])[cH:24][cH:25][cH:26][c:27]2[CH3:28])[n:9][n:10]([C:12]([N:13]([CH2:14][CH3:15])[CH2:16][CH3:17])=[O:18])[c:11]1[S:32][CH3:31]