HRID1234914

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8471

Triethylamine

C6H15N

HCID2608606

N-(2,6-Dimethylphenyl)-1-piperazineacetamide

C14H21N3O

HCID58844915

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(NC(=O)CC(O)CN2CCN(CC(=O)Nc3c(C)cccc3C)CC2)cc1

HCID18452691

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0ab583f0257f45e1855efef1b0476645
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

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