HRID178158

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11460084

2,4-di-tert-butyl-6-piperazin-1-ylpyrimidine

C16H28N4

HCID68582896

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：CC(C)(C)c1cc(N2CCN(CCCCN3C(=O)CCC(=O)c4ccccc43)CC2)nc(C(C)(C)C)n1

HCID68583152

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ff1bc1bc9402416780e3222a29bac082
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

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