HRID202497

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID962

Water

H2O

HCID8471

Triethylamine

C6H15N

HCID612023

6-Bromo-N-(6-methoxy-4-methyl-8-quinolinyl)hexanamide

C17H21BrN2O2

HCID13077525

3-Methyl-1-(3-methylbutyl)piperazine

C10H22N2

PRODUCTS

生成物

结构：COc1cc(NC(=O)CCCCCN2CCN(CCC(C)C)CC2C)c2nccc(C)c2c1

HCID20207179

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6ee9e8fe7e4748b8ba6b2edd7b841c7f
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

[Br:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][C:7](=[O:8])[NH:9][c:10]1[cH:11][c:12]([O:21][CH3:22])[cH:13][c:14]2[c:15]([CH3:20])[cH:16][cH:17][n:18][c:19]12.[CH3:23][CH:24]([CH2:25][CH2:26][N:27]1[CH2:28][CH:29]([CH3:33])[NH:30][CH2:31][CH2:32]1)[CH3:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[OH2:42].[cH:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][C:7](=[O:8])[NH:9][c:10]1[cH:11][c:12]([O:21][CH3:22])[cH:13][c:14]2[c:15]([CH3:20])[cH:16][cH:17][n:18][c:19]12)[N:30]1[CH:29]([CH3:33])[CH2:28][N:27]([CH2:26][CH2:25][CH:24]([CH3:23])[CH3:34])[CH2:32][CH2:31]1