HRID1221395

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID31374

Dimethylacetamide

C4H9NO

HCID166653

Hydride

H-

HCID9906257

tert-Butyl 4'-(bromomethyl)biphenyl-2-carboxylate

C18H19BrO2

HCID178441752

未命名化合物

PRODUCTS

生成物

结构：CCCCc1nc(C(=O)CC)c(C#N)n1Cc1ccc(-c2ccccc2C(=O)OC(C)(C)C)cc1

HCID19036156

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2728845b6f724ae999f10416db20ab72
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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