HRID1228681

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID923

Sodium ion

Na+

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID81531

Diisopropylethylamine

C8H19N

HCID411179

1-(2,4-Dichlorobenzyl)piperazine

C11H14Cl2N2

HCID59337587

未命名化合物

PRODUCTS

产物

HCID11718810

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6e9c298e89574ee0b2027106db3fccad
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-:31].[CH3:41][N:42]1[CH2:43][CH2:44][CH2:45][C:46]1=[O:47].[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[Cl:15][c:16]1[c:17]([CH2:18][N:19]2[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]2)[cH:25][cH:26][c:27]([Cl:29])[cH:28]1.[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][n:6]1[c:7](=[O:14])[nH:8][c:9](=[O:13])[c:10]([CH3:12])[cH:11]1.[Na+:30]>>[CH2:2]([CH2:3][CH2:4][CH2:5][n:6]1[c:7](=[O:14])[nH:8][c:9](=[O:13])[c:10]([CH3:12])[cH:11]1)[N:22]1[CH2:21][CH2:20][N:19]([CH2:18][c:17]2[c:16]([Cl:15])[cH:28][c:27]([Cl:29])[cH:26][cH:25]2)[CH2:24][CH2:23]1