HRID681827

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8056

1,4-Dibromobutane

C4H8Br2

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

结构：CNC(=O)c1c(-c2ccc(C)cc2)oc2nc(NS(C)(=O)=O)c(I)cc12

HCID58052356

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)c1c(-c2ccc(C)cc2)oc2nc(N(CCCCBr)S(C)(=O)=O)c(I)cc12

HCID58052297

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c8496c67909a470abfba14495d0d9998
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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