HRID1213775

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8082

Piperidine

C5H11N

HCID22561809

未命名化合物

HCID22561960

4-(3,5-dimethylpiperazine-1-carbonyl)-3-methyl-1H-pyrrole-2-carbaldehyde

C13H19N3O2

PRODUCTS

产物

HCID69741739

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-38a27cddf86f4d31a3322849759c5d39
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

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