HRID305744

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID62493

2,2-Dimethylpropanoyl chloride

C5H9ClO

HCID81531

Diisopropylethylamine

C8H19N

HCID11195002

未命名化合物

HCID58298448

4-(Aminomethyl)-α,α,3-trimethylbenzeneacetonitrile

C12H16N2

PRODUCTS

生成物

结构：Cc1cc(C(C)(C)C#N)ccc1CNC(=O)Cn1cnc2cccc(C#N)c21

HCID59804259

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b2754d93de614644a51362b07e11d51f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1](#[N:2])[c:3]1[cH:4][cH:5][cH:6][c:7]2[c:8]1[n:9]([CH2:12][C:13](=[O:14])[OH:15])[cH:10][n:11]2.[C:25]([Cl:26])(=[O:27])[C:28]([CH3:29])([CH3:30])[CH3:31].[CH:16]([N:17]([CH2:18][CH3:19])[CH:20]([CH3:21])[CH3:22])([CH3:23])[CH3:24].[Cl:46][CH2:47][Cl:48].[NH2:32][CH2:33][c:34]1[c:35]([CH3:45])[cH:36][c:37]([C:40]([C:41]#[N:42])([CH3:43])[CH3:44])[cH:38][cH:39]1>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][cH:6][c:7]2[c:8]1[n:9]([CH2:12][C:13](=[O:15])[NH:32][CH2:33][c:34]1[c:35]([CH3:45])[cH:36][c:37]([C:40]([C:41]#[N:42])([CH3:43])[CH3:44])[cH:38][cH:39]1)[cH:10][n:11]2