HRID950448

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2794561

1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-sulfonyl chloride

C5H4ClF3N2O2S

结构：COc1ccc(S(=O)(=O)NCc2ccc(-c3cc(F)ccc3OC)c(OC)c2)cc1

HCID24768914

未命名化合物

PRODUCTS

生成物

结构：COc1cc(CNS(=O)(=O)c2cn(C)nc2C(F)(F)F)ccc1-c1cc(F)ccc1OC

HCID24769077

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4130bb7c0905442e80e75811f4c48468
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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