HRID103109

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID5354618

Cesium

HCID53817436

未命名化合物

HCID178516151

未命名化合物

PRODUCTS

产物

HCID18922609

4,6-diethoxy-2-[1-phenyl-3-trifluoromethylpyrazol-5-yl-oxymethyl]-1,2-benzisothiazol-3(2H)-one 1,1-dioxide

C22H20F3N3O6S

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ac2458a1e4b24f5899e28ba7e56caeb6
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

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