HRID208212

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID82191

1-Piperazinecarboxaldehyde

C5H10N2O

HCID98210

3-Pyrrolidinol

C4H9NO

HCID21906809

未命名化合物

PRODUCTS

产物

HCID21906755

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-39c9476fdcc04504b17f98e9441319a2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

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