HRID813994

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID11063234

2-methoxy-6-(trifluoromethyl)aniline

C8H8F3NO

结构：CCOC(=O)c1c(S(=O)(=O)Cl)nn2c(C)cc(C)nc12

HCID15725415

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1c(S(=O)(=O)Nc2c(OC)cccc2C(F)(F)F)nn2c(C)cc(C)nc12

HCID15725422

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-10776b85e3a3421e8fdede80a8a835cc
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-:34].[C:14](=[O:15])([O:16][CH2:17][CH3:18])[c:19]1[c:20]([S:30](=[O:31])(=[O:32])[Cl:33])[n:21][n:22]2[c:23]1[n:24][c:25]([CH3:29])[cH:26][c:27]2[CH3:28].[CH3:42][C:43](=[O:44])[CH3:45].[Cl:46][CH2:47][Cl:48].[F:1][C:2]([c:3]1[c:4]([NH2:5])[c:6]([O:10][CH3:11])[cH:7][cH:8][cH:9]1)([F:12])[F:13].[K+:35].[cH:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1>>[F:1][C:2]([c:3]1[c:4]([NH:5][S:30]([c:20]2[c:19]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:23]3[n:22]([n:21]2)[c:27]([CH3:28])[cH:26][c:25]([CH3:29])[n:24]3)(=[O:31])=[O:32])[c:6]([O:10][CH3:11])[cH:7][cH:8][cH:9]1)([F:12])[F:13]