HRID1153212

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID2756810

tert-Butyl 3-methylpiperazine-1-carboxylate

C10H20N2O2

HCID62415207

未命名化合物

PRODUCTS

生成物

结构：CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc(NC(=O)NC2CCC2)cc1

HCID70806790

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1baeb7c637e74c14b06dcd8747a8ffd9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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