HRID1208696

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID10538364

methyl 4-fluoro-5-methanesulfonyl-2-methylbenzoate

C10H11FO4S

HCID68463636

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(S(C)(=O)=O)c(N2CC(c3ccc(F)cc3)CS2(=O)=O)cc1C

HCID68462085

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e2eeb6d62c46421eaf92085ea18cc08d
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

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