HRID1145264

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID3283

Diethyl Ether

C4H10O

结构：CCCc1nc(C#N)c(C#N)n1C(c1ccccc1)(c1ccccc1)c1ccccc1

HCID19036122

2-Propyl-1-(triphenylmethyl)-1H-imidazole-4,5-dicarbonitrile

C27H22N4

HCID178461628

未命名化合物

PRODUCTS

生成物

结构：CCCc1nc(C(=O)CC)c(C#N)n1C(c1ccccc1)(c1ccccc1)c1ccccc1

HCID19036223

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e56302316274450a82ad64f8770df90b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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