HRID2323526

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

HCID8071

未命名化合物

HCID28179

Fluoride

F-

HCID105144

Palladium(2+)

Pd+2

结构：CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1

HCID2734217

2-Dicyclohexylphosphino-2'-(N,N-dimethylamino)biphenyl

C26H36NP

HCID2734324

5-Chlorothiophene-2-boronic acid

C4H4BClO2S

HCID21985564

未命名化合物

PRODUCTS

生成物

HCID21985583

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-afd47f2fcdb149339e827085482a6df1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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