HRID2137858

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID45787872

4-Bromo-2-tert-butoxypyridine

C9H12BrNO

HCID71149972

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)Oc1cc(-c2ccc(CNC(=O)c3c(Cl)cccc3Cl)cc2)ccn1

HCID71149992

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6141dbe9376443fda878339a1bb1485b
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:28][c:29]1[cH:30][c:31]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[n:32][cH:33][cH:34]1.[C:22](=[O:23])([O-:24])[O-:25].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][c:8]2[cH:9][cH:10][c:11]([B:14]([OH:15])[OH:16])[cH:12][cH:13]2)[c:17]([Cl:21])[cH:18][cH:19][cH:20]1.[K+:26].[K+:27].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][c:8]2[cH:9][cH:10][c:11](-[c:29]3[cH:30][c:31]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[n:32][cH:33][cH:34]3)[cH:12][cH:13]2)[c:17]([Cl:21])[cH:18][cH:19][cH:20]1