HRID303069

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID105144

Palladium(2+)

Pd+2

HCID2734378

3-Pyridinylboronic acid

C5H6BNO2

HCID58071307

未命名化合物

PRODUCTS

生成物

HCID66711275

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6a2d3789f56947eeadfa734e02c1b4d6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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