HRID2127643

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

2 次

HCID2734895

5-Bromo-2-methoxypyridine

C6H6BrNO

结构：COC(=O)c1ccc(OS(=O)(=O)C(F)(F)F)c(Cl)c1

HCID21841505

Methyl 3-chloro-4-[[(trifluoromethyl)sulfonyl]oxy]benzoate

C9H6ClF3O5S

PRODUCTS

生成物

HCID54494848

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fc6c746d0f2840b0a54f88dcdf27a32c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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