HRID698615

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6342

Acetonitrile

C2H3N

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID12286

3-Bromopyridine

C5H4BrN

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

HCID105144

Palladium(2+)

Pd+2

HCID543133

2H-Pyran-2-one, 4-ethenyltetrahydro-

C7H10O2

PRODUCTS

生成物

HCID54134237

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c1253f9af4c24f14836429c6f33e5de2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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