HRID2122801

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID1084

Thiosulfate(2-)

O3S2-2

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID31398

N-Chlorosuccinimide

C4H4ClNO2

结构：NS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)cc2-c2ccc(Br)cc2)cn1

HCID12968617

未命名化合物

PRODUCTS

生成物

结构：NS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)c(Cl)c2-c2ccc(Br)cc2)cn1

HCID22313805

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3df98c8a42ba4b40950f196df0790dcc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([C:23]([F:24])([F:25])[F:26])[n:11][n:12]2-[c:13]2[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[NH2:22])[n:17][cH:18]2)[cH:6][cH:7]1.[CH3:42][CH2:43][O:44][CH2:45][CH3:46].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[Cl:27][N:28]1[C:29](=[O:30])[CH2:31][CH2:32][C:33]1=[O:34].[Na+:40].[Na+:41].[S:35]([O-:36])([O-:37])(=[O:38])=[S:39]>>[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([Cl:27])[c:10]([C:23]([F:24])([F:25])[F:26])[n:11][n:12]2-[c:13]2[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[NH2:22])[n:17][cH:18]2)[cH:6][cH:7]1