HRID137631

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8471

Triethylamine

C6H15N

HCID840301

3-Pyridinecarboxamide, 2-chloro-N-(4-methoxyphenyl)-

C13H11ClN2O2

HCID10607746

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(NC(=O)c2cccnc2NCC2CCN(c3ccncc3)CC2)cc1

HCID9844870

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ebab493a73b2471d8329a8816b9d91a2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][CH2:41][OH:42].[Cl:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1[C:8](=[O:9])[NH:10][c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1.[n:19]1[cH:20][cH:21][c:22]([N:25]2[CH2:26][CH2:27][CH:28]([CH2:31][NH2:32])[CH2:29][CH2:30]2)[cH:23][cH:24]1>>[c:2]1([NH:32][CH2:31][CH:28]2[CH2:27][CH2:26][N:25]([c:22]3[cH:21][cH:20][n:19][cH:24][cH:23]3)[CH2:30][CH2:29]2)[n:3][cH:4][cH:5][cH:6][c:7]1[C:8](=[O:9])[NH:10][c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1