HRID184357

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID2758336

2,4-Difluoro-1-(methanesulfonyl)benzene

C7H6F2O2S

结构：CC(C)(C)OC(=O)N1CCC(Oc2cc(=O)[nH]cc2Cl)CC1

HCID58467944

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(Oc2cc(=O)n(-c3ccc(S(C)(=O)=O)c(F)c3)cc2Cl)CC1

HCID58467945

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fbf0f53df126449b9e0c6c5c3332e376
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

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