HRID126386

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID166653

Hydride

H-

HCID562880

Methyl 2-(4-methylphenylsulfonamido)acetate

C10H13NO4S

结构：CCOC(=O)c1c(Br)c(Br)n(Cc2ccc(F)cc2)c1CBr

HCID53237464

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1c(Br)c(Br)n(Cc2ccc(F)cc2)c1CN(CC(=O)OC)S(=O)(=O)c1ccc(C)cc1

HCID53237465

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0e7c8204a75b40b68f0777554f1c0203
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

[Br:19][c:20]1[c:21]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[c:22]([CH2:34][Br:35])[n:23]([CH2:26][c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[c:24]1[Br:25].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH2:12][C:13](=[O:14])[O:15][CH3:16])[cH:6][cH:7]1.[CH3:41][OH:42].[Cl:48][CH2:49][Cl:50].[H-:18].[Na+:17].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][C:13](=[O:14])[O:15][CH3:16])[CH2:34][c:22]2[c:21]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[c:20]([Br:19])[c:24]([Br:25])[n:23]2[CH2:26][c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[cH:6][cH:7]1