HRID120606

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID22593745

未命名化合物

HCID59456959

N-Methyl-1-propyl-2-naphthalenemethanamine

C15H19N

HCID66966201

未命名化合物

HCID66966295

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：Cc1c(CN(C)C(=O)C=Cc2cnc(N)c(CN3CCOCC3)c2)sc2ccccc12

HCID66967277

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3fcb6114ed5e46749100b7bee9f28647
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:21][N:22]1[CH2:23][c:24]2[cH:25][c:26]([CH:27]=[CH:28][C:29]([OH:30])=[O:31])[cH:32][n:33][c:34]2[NH:35][C:36](=[O:37])[CH2:38]1.[CH3:39][NH:40][CH2:41][c:42]1[c:43]([CH3:51])[c:44]2[c:45]([s:46]1)[cH:47][cH:48][cH:49][cH:50]2.[CH3:52][NH:53][CH2:54][c:55]1[cH:56][cH:57][c:58]2[c:59]([cH:60][cH:61][cH:62][cH:63]2)[c:64]1[CH2:65][CH2:66][CH3:67].[ClH:20].[NH2:1][c:2]1[c:3]([CH2:13][N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[cH:4][c:5]([CH:8]=[CH:9][C:10](=[O:11])[OH:12])[cH:6][n:7]1>>[ClH:20].[NH2:1][c:2]1[c:3]([CH2:13][N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[cH:4][c:5]([CH:8]=[CH:9][C:10](=[O:12])[N:40]([CH3:39])[CH2:41][c:42]2[c:43]([CH3:51])[c:44]3[c:45]([s:46]2)[cH:47][cH:48][cH:49][cH:50]3)[cH:6][n:7]1