HRID175010

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID2756810

tert-Butyl 3-methylpiperazine-1-carboxylate

C10H20N2O2

HCID17954460

2-Chloro-1-methyl[4,4'-bipyrimidin]-6(1H)-one

C9H7ClN4O

PRODUCTS

生成物

结构：CC1CN(C(=O)OC(C)(C)C)CCN1c1nc(-c2ccncn2)cc(=O)n1C

HCID178430790

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6af70e57344e48d9b9d3e0eb36a35a39
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

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