HRID143699

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID3776

Isopropanol

C3H8O

HCID11529063

4-Amino-3-methoxy-N-(1-methyl-4-piperidinyl)benzamide

C14H21N3O2

HCID86617549

未命名化合物

PRODUCTS

生成物

结构：C#CCN1CCC(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc21

HCID86617548

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-352d6e3d2a584d99916b2e702a7da0e7
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

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