HRID2161577

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID176

Acetic Acid

C2H4O2

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID27099

Copper(2+)

Cu+2

HCID735132

3-Methyl-1-(pyridin-2-yl)-1H-pyrazol-5-amine

C9H10N4

HCID22320256

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1c(Nc2cc(C)nn2-c2ccccn2)ccc(F)c1F

HCID22320113

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e929d90f26e94fafa435f44b3ced4a57
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:14][c:15]1[cH:16][cH:17][c:18]([F:26])[c:19]([F:25])[c:20]1[C:21](=[O:22])[O:23][CH3:24].[C:27](=[O:28])([O-:29])[O-:30].[C:39]([O-:40])(=[O:41])[CH3:42].[C:44]([O-:45])(=[O:46])[CH3:47].[CH3:1][c:2]1[n:3][n:4](-[c:8]2[n:9][cH:10][cH:11][cH:12][cH:13]2)[c:5]([NH2:7])[cH:6]1.[CH3:34][N:35]([CH3:36])[CH:37]=[O:38].[CH3:48][C:49](=[O:50])[OH:51].[Cu+2:43].[K+:31].[K+:32].[OH2:33]>>[CH3:1][c:2]1[n:3][n:4](-[c:8]2[n:9][cH:10][cH:11][cH:12][cH:13]2)[c:5]([NH:7][c:15]2[cH:16][cH:17][c:18]([F:26])[c:19]([F:25])[c:20]2[C:21](=[O:22])[O:23][CH3:24])[cH:6]1