HRID150126

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID79304

Methanone, diphenyl-, hydrazone

C13H12N2

HCID104967

Cesium(1+)

Cs+

2 次

HCID105144

Palladium(2+)

Pd+2

HCID68828530

Methyl 4-bromo-5-cyanofuran-2-carboxylate

C7H4BrNO3

PRODUCTS

产物

HCID86606584

Methyl 5-cyano-4-[2-(diphenylmethylene)hydrazinyl]-2-furancarboxylate

C20H15N3O3

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-fb3f775e70f442c58d20964fc37cdbf8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

[Br:7][c:8]1[cH:9][c:10]([C:15](=[O:16])[O:17][CH3:18])[o:11][c:12]1[C:13]#[N:14].[C:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)=[N:32][NH2:33].[C:1](=[O:2])([O-:3])[O-:4].[C:41]([O-:42])(=[O:43])[CH3:44].[C:46]([O-:47])(=[O:48])[CH3:49].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cs+:5].[Cs+:6].[Pd+2:45]>>[c:8]1([NH:33][N:32]=[C:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:9][c:10]([C:15](=[O:16])[O:17][CH3:18])[o:11][c:12]1[C:13]#[N:14]