HRID672934

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

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

C17H14O

3 次

HCID104967

Cesium(1+)

Cs+

2 次

HCID4302175

4-Amino-2-chloro-5-methylpyrimidine

C5H6ClN3

HCID19607721

1-Bromo-2,4-dichloro-5-methoxybenzene

C7H5BrCl2O

PRODUCTS

生成物

HCID57516481

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d5fe0a018db741588f8357138e0c609d
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:10][c:11]1[c:12]([Cl:20])[cH:13][c:14]([Cl:19])[c:15]([O:17][CH3:18])[cH:16]1.[C:21](=[O:22])([O-:23])[O-:24].[CH2:27]1[O:28][CH2:29][CH2:30][O:31][CH2:32]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([CH3:9])[c:6]([NH2:8])[n:7]1.[Cs+:25].[Cs+:26].[O:35]=[C:36]([CH:37]=[CH:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[CH:45]=[CH:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[O:53]=[C:54]([CH:55]=[CH:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1)[CH:63]=[CH:64][c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1.[O:71]=[C:72]([CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1)[CH:81]=[CH:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1.[Pd:33].[Pd:34]>>[Cl:1][c:2]1[n:3][cH:4][c:5]([CH3:9])[c:6]([NH:8][c:11]2[c:12]([Cl:20])[cH:13][c:14]([Cl:19])[c:15]([O:17][CH3:18])[cH:16]2)[n:7]1