HRID1568792

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID26255

Tetrafluoroborate

BF4-

HCID31738

4-Benzylpiperidine

C12H17N

HCID130500

未命名化合物

结构：COc1c(C)cc(C2CCc3nc(C(=O)O)cn3C2)cc1C

HCID24715046

6-(4-Methoxy-3,5-dimethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxylic acid

C17H20N2O3

PRODUCTS

生成物

结构：COc1c(C)cc(C2CCc3nc(C(=O)N4CCC(Cc5ccccc5)CC4)cn3C2)cc1C

HCID46081128

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-98dcf23f9c7d4f02ae917ef5afcf82ed
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[B-:1]([F:2])([F:3])([F:4])[F:5].[CH2:53]([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)[CH:60]1[CH2:61][CH2:62][NH:63][CH2:64][CH2:65]1.[CH3:23][N:24]1[CH2:25][CH2:26][O:27][CH2:28][CH2:29]1.[CH3:31][O:32][c:33]1[c:34]([CH3:52])[cH:35][c:36]([CH:40]2[CH2:41][CH2:42][c:43]3[n:44]([cH:46][c:47]([C:49](=[O:50])[OH:51])[n:48]3)[CH2:45]2)[cH:37][c:38]1[CH3:39].[ClH:30].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[n:6]1([O:7][C:8]([N:9]([CH3:10])[CH3:11])=[N+:12]([CH3:13])[CH3:14])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[n:21][n:22]1>>[CH3:31][O:32][c:33]1[c:34]([CH3:52])[cH:35][c:36]([CH:40]2[CH2:41][CH2:42][c:43]3[n:44]([cH:46][c:47]([C:49](=[O:51])[N:63]4[CH2:62][CH2:61][CH:60]([CH2:53][c:54]5[cH:55][cH:56][cH:57][cH:58][cH:59]5)[CH2:65][CH2:64]4)[n:48]3)[CH2:45]2)[cH:37][c:38]1[CH3:39]