HRID208024

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID19660

Carbonate Ion

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID954258

4-Iodobenzyl bromide

C7H6BrI

HCID5016530

未命名化合物

PRODUCTS

产物

HCID86590423

2-[(4-Iodo-benzyl)-(4-methoxy-2,3,6-trimethyl-benzenesulfonyl)-amino]-3-phenyl-propionic acid methyl ester

C27H30INO5S

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6914ce0bc9d949d6ad12d4926363b84d
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

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