HRID819940

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6344

Dichloromethane

CH2Cl2

HCID7369

Benzenesulfonyl chloride

C6H5ClO2S

HCID61778

Bisulfate anion

HO4S-

HCID81531

Diisopropylethylamine

C8H19N

HCID67000657

未命名化合物

PRODUCTS

生成物

结构：O=C(CN(CC(O)c1cccc(Br)c1)S(=O)(=O)c1ccccc1)Nc1ccccc1

HCID67001090

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab3844ceee6446e0af14e034f6ff4b91
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([CH:8]([CH2:9][NH:10][CH2:11][C:12](=[O:13])[NH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[OH:21])[cH:5][cH:6][cH:7]1.[CH2:47]([Cl:48])[Cl:49].[CH:22]([N:23]([CH2:24][CH3:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[K+:46].[S:41](=[O:42])(=[O:43])([OH:44])[O-:45].[c:31]1([S:37](=[O:38])(=[O:39])[Cl:40])[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[Br:1][c:2]1[cH:3][c:4]([CH:8]([CH2:9][N:10]([CH2:11][C:12](=[O:13])[NH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[S:37]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)(=[O:38])=[O:39])[OH:21])[cH:5][cH:6][cH:7]1