HRID93304

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID19660

Carbonate

CO3-2

HCID24290

未命名化合物

HCID2779353

3-Fluoropyridine-4-boronic acid

C5H5BFNO2

HCID21508848

未命名化合物

PRODUCTS

生成物

结构：Fc1cnccc1-c1ccc2c(c1)C(c1ccccc1)=NCCN2

HCID11638282

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5c0d6dab9cbc4d23b0932b8a1a6b8e44
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

[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[C:7]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)=[N:8][CH2:9][CH2:10][NH:11]2.[C:34](=[O:35])([O-:36])[O-:37].[CH3:19][N:20]([CH3:21])[CH:22]=[O:23].[F:24][c:25]1[cH:26][n:27][cH:28][cH:29][c:30]1[B:31]([OH:32])[OH:33].[K+:38].[K+:39].[OH2:81].[Pd:40]([Cl:41])[Cl:42].[c:43]1([P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:57][cH:58][cH:59][cH:60][cH:61]1.[c:62]1([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[cH:76][cH:77][cH:78][cH:79][cH:80]1>>[c:2]1(-[c:30]2[c:25]([F:24])[cH:26][n:27][cH:28][cH:29]2)[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[C:7]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)=[N:8][CH2:9][CH2:10][NH:11]2