HRID2334488

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID2734882

4-Isopropylbenzenesulfonyl chloride

C9H11ClO2S

HCID22281943

未命名化合物

PRODUCTS

生成物

结构：COc1nn(C)c(NS(=O)(=O)c2ccc(C(C)C)cc2)c1-c1ccc2c(c1)OCO2

HCID22281973

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-92fedddce0bb41b4961e53255974dee7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH3:32][N:33]([c:34]1[cH:35][cH:36][cH:37][cH:38][n:39]1)[CH3:40].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[Cl:13])[cH:8][cH:9]1.[NH2:14][c:15]1[c:16](-[c:23]2[cH:24][c:25]3[c:26]([cH:30][cH:31]2)[O:27][CH2:28][O:29]3)[c:17]([O:21][CH3:22])[n:18][n:19]1[CH3:20].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[NH:14][c:15]2[c:16](-[c:23]3[cH:24][c:25]4[c:26]([cH:30][cH:31]3)[O:27][CH2:28][O:29]4)[c:17]([O:21][CH3:22])[n:18][n:19]2[CH3:20])[cH:8][cH:9]1