HRID1211658

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID24401

Permanganate Ion

MnO4-

结构：CS(=O)c1ccc(C(O)(CC2CCC2)c2cc3cc(F)cnc3n2S(=O)(=O)c2ccccc2)cc1

HCID67229076

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)c1ccc(C(O)(CC2CCC2)c2cc3cc(F)cnc3n2S(=O)(=O)c2ccccc2)cc1

HCID67228040

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-52522302dfeb45ce8ff8763d3400edfc
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

[CH3:42][OH:43].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[K+:41].[Mn:36](=[O:37])([O-:38])(=[O:39])=[O:40].[OH2:44].[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[c:11]([C:20]([CH2:21][CH:22]3[CH2:23][CH2:24][CH2:25]3)([OH:26])[c:27]3[cH:28][cH:29][c:30]([S:33](=[O:34])[CH3:35])[cH:31][cH:32]3)[cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([F:19])[cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[c:11]([C:20]([CH2:21][CH:22]3[CH2:23][CH2:24][CH2:25]3)([OH:26])[c:27]3[cH:28][cH:29][c:30]([S:33](=[O:34])([CH3:35])=[O:37])[cH:31][cH:32]3)[cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([F:19])[cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1