HRID805006

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID14906

2-Chlorostyrene

C8H7Cl

HCID61739

Hypochlorite

ClO-

结构：Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2nc(-c3cc(-c4ccccc4)on3)cs2)CC1

HCID68742226

未命名化合物

结构：Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2nc(C=NO)cs2)CC1

HCID86631243

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2nc(C3=NOC(c4ccccc4Cl)C3)cs2)CC1

HCID68745534

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c6c2d9c063a74a07a556179374244669
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:10][CH2:11][N:12]([CH2:13][CH3:14])[CH2:15][CH3:16].[CH3:47][c:48]1[n:49]([CH2:50][C:51]([N:52]2[CH2:53][CH2:54][CH:55]([c:56]3[s:57][cH:58][c:59](-[c:60]4[cH:61][c:62](-[c:63]5[cH:64][cH:65][cH:66][cH:67][cH:68]5)[o:69][n:70]4)[n:71]3)[CH2:72][CH2:73]2)=[O:74])[n:75][c:76]([C:77]([F:78])([F:79])[F:80])[cH:81]1.[Cl:17][O-:18].[Cl:1][c:2]1[c:3]([CH:8]=[CH2:9])[cH:4][cH:5][cH:6][cH:7]1.[Cl:82][CH2:83][Cl:84].[Na+:19].[OH:20][N:21]=[CH:22][c:23]1[n:24][c:25]([CH:28]2[CH2:29][CH2:30][N:31]([C:34]([CH2:35][n:36]3[n:37][c:38]([C:42]([F:43])([F:44])[F:45])[cH:39][c:40]3[CH3:41])=[O:46])[CH2:32][CH2:33]2)[s:26][cH:27]1>>[Cl:1][c:2]1[c:3]([CH:8]2[CH2:9][C:22]([c:23]3[n:24][c:25]([CH:28]4[CH2:29][CH2:30][N:31]([C:34]([CH2:35][n:36]5[n:37][c:38]([C:42]([F:43])([F:44])[F:45])[cH:39][c:40]5[CH3:41])=[O:46])[CH2:32][CH2:33]4)[s:26][cH:27]3)=[N:21][O:20]2)[cH:4][cH:5][cH:6][cH:7]1