HRID1202668

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID2795193

5-Pyrimidinylboronic acid

C4H5BN2O2

结构：NC1=NC(c2ccnc(C(F)(F)F)c2)(c2ccc(F)c(Br)c2)c2cccc(F)c21

HCID58579492

未命名化合物

PRODUCTS

生成物

结构：NC1=NC(c2ccnc(C(F)(F)F)c2)(c2ccc(F)c(-c3cncnc3)c2)c2cccc(F)c21

HCID46206291

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b8fa5984273c42b6988b9a2d641ab553
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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