HRID1200540

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID7683

Acetamide, N-(4-bromophenyl)-

C8H8BrNO

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

4 次

HCID581760

3-Thiopheneboronic acid

C4H5BO2S

PRODUCTS

生成物

HCID57875827

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5afab9b3c3fb4e9f999e0c46d14230b1
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:22][c:23]1[cH:24][cH:25][c:26]([NH:29][C:30]([CH3:31])=[O:32])[cH:27][cH:28]1.[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Na+:8].[Na+:9].[O-:10][C:11](=[O:12])[O-:13].[OH2:62].[Pd:58].[Pd:59].[Pd:60].[Pd:61].[c:39]1([P:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:53][cH:54][cH:55][cH:56][cH:57]1.[s:14]1[cH:15][c:16]([B:19]([OH:20])[OH:21])[cH:17][cH:18]1>>[s:14]1[cH:15][c:16](-[c:23]2[cH:24][cH:25][c:26]([NH:29][C:30]([CH3:31])=[O:32])[cH:27][cH:28]2)[cH:17][cH:18]1