HRID162170

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1049

Pyridine

C5H5N

HCID70693

Acetic acid, cyano-, 1,1-dimethylethyl ester

C7H11NO2

HCID166653

Hydride

H-

HCID24771093

未命名化合物

PRODUCTS

产物

HCID57767017

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0d993506054c4f0f8ffed3f320bff50b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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