HRID2322323

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID26255

Tetrafluoroborate

BF4-

HCID130500

未命名化合物

HCID670823

4-chloro-1-methyl-1H-pyrazole-5-carboxylic acid

C5H5ClN2O2

HCID56955502

2-Phenylimidazo[1,2-a]pyridin-7-amine

C13H11N3

PRODUCTS

生成物

结构：Cn1ncc(Cl)c1C(=O)Nc1ccn2cc(-c3ccccc3)nc2c1

HCID51034816

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9b2ab638b2ef4c17b540ad7997c776a0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[B-:1]([F:2])([F:3])([F:4])[F:5].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[Cl:23][c:24]1[c:25]([C:30](=[O:31])[OH:32])[n:26]([CH3:29])[n:27][cH:28]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[c:33]1(-[c:39]2[n:40][c:41]3[n:42]([cH:43][cH:44][c:45]([NH2:47])[cH:46]3)[cH:48]2)[cH:34][cH:35][cH:36][cH:37][cH:38]1.[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>>[Cl:23][c:24]1[c:25]([C:30](=[O:32])[NH:47][c:45]2[cH:44][cH:43][n:42]3[c:41]([n:40][c:39](-[c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)[cH:48]3)[cH:46]2)[n:26]([CH3:29])[n:27][cH:28]1