HRID1152622

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7854

Propionitrile

C3H5N

HCID30165

Iodide ion

I-

HCID81531

Diisopropylethylamine

C8H19N

HCID10514345

未命名化合物

HCID60051142

未命名化合物

HCID68784930

未命名化合物

PRODUCTS

产物

HCID75236154

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-c66cbcbd36d548de965dd638ee62730b
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

[C:33]([CH2:34][P+:35]([CH3:36])([CH3:37])[CH3:38])#[N:39].[C:49](#[N:50])[CH2:51][CH3:52].[CH3:17][c:18]1[cH:19][c:20]([C:21]#[N:22])[cH:23][cH:24][c:25]1[N:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1.[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[I-:32].[OH:1][CH2:2][c:3]1[cH:4][c:5]2[c:10]([n:11][cH:12]1)[N:9]1[CH:8]([C:7](=[O:16])[NH:6]2)[CH2:15][CH2:14][CH2:13]1>>[CH2:2]([c:3]1[cH:4][c:5]2[c:10]([n:11][cH:12]1)[N:9]1[CH:8]([C:7](=[O:16])[NH:6]2)[CH2:15][CH2:14][CH2:13]1)[N:29]1[CH2:28][CH2:27][N:26]([c:25]2[c:18]([CH3:17])[cH:19][c:20]([C:21]#[N:22])[cH:23][cH:24]2)[CH2:31][CH2:30]1