HRID701593

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID76187

Benzenesulfonyl chloride, 2-chloro-

C6H4Cl2O2S

HCID81531

Diisopropylethylamine

C8H19N

结构：O=C(CC(=O)N1CCNCC1)Nc1ccc(-c2ccccc2)cc1

HCID57875812

未命名化合物

PRODUCTS

生成物

结构：O=C(CC(=O)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1)Nc1ccc(-c2ccccc2)cc1

HCID44231085

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-273ba1cb9e7740ada337788327a494e9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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