HRID185417

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：NS(=O)(=O)c1ccc(F)c(S(=O)(=O)C(F)(F)F)c1

HCID25058452

4-Fluoro-3-(trifluoromethanesulfonyl)benzene-1-sulfonamide

C7H5F4NO4S2

HCID74423210

未命名化合物

PRODUCTS

生成物

结构：NS(=O)(=O)c1ccc(NC(CCN2CCOCC2)CSc2ccccc2)c(S(=O)(=O)C(F)(F)F)c1

HCID66723667

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f65f036910a340a08a3cdea24ce04fc9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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