HRID668076

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

Dimethylformamide

C3H7NO

HCID8857

Ethyl Acetate

C4H8O2

HCID19660

Carbonate Ion

CO3-2

HCID68021

4-Fluorobenzyl bromide

C7H6BrF

HCID136337138

未命名化合物

PRODUCTS

产物

HCID67009914

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6cf5052052ab4e2bb6d1fdbcf924bc79
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:32][CH2:33][c:34]1[cH:35][cH:36][c:37]([F:40])[cH:38][cH:39]1.[C:41](=[O:42])([O-:43])[O-:44].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[CH:1]1([c:4]2[n:5][n:6]3[c:7]([nH:8][c:9](=[O:30])[c:10]([CH2:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]5)[cH:20][cH:21]4)[c:11]3[CH2:12][CH2:13][CH3:14])[n:31]2)[CH2:2][CH2:3]1.[K+:45].[K+:46]>>[CH:1]1([c:4]2[n:5][n:6]3[c:7]([n:8]([CH2:33][c:34]4[cH:35][cH:36][c:37]([F:40])[cH:38][cH:39]4)[c:9](=[O:30])[c:10]([CH2:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]5)[cH:20][cH:21]4)[c:11]3[CH2:12][CH2:13][CH3:14])[n:31]2)[CH2:2][CH2:3]1