HRID98103

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID222872

4-tert-Butylbenzenesulfonamide

C10H15NO2S

HCID5462222

Potassium

结构：COc1ccc(Cl)c(Oc2c(C)nc(N3CCOCC3)nc2Cl)c1

HCID18938910

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(Cl)c(Oc2c(C)nc(N3CCOCC3)nc2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1

HCID19934735

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a4adcaa6029148cfa343a423cb81c3f4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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