HRID1214534

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

HCID3614350

3,5-DIBROMO-1-METHYLPYRIDIN-2(1H)-ONE

C6H5Br2NO

HCID58043933

5-Methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-amine

C7H12N4

PRODUCTS

生成物

HCID58043884

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-23a24cdc395b4923a55f0862caddfc47
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br:12][c:13]1[c:14](=[O:21])[n:15]([CH3:20])[cH:16][c:17]([Br:19])[cH:18]1.[C:22](=[O:23])([O-:24])[O-:25].[CH3:1][N:2]1[CH2:3][c:4]2[n:5]([n:8][c:9]([NH2:11])[cH:10]2)[CH2:6][CH2:7]1.[Cs+:26].[Cs+:27].[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[O:36]=[C:37]([CH:38]=[CH:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)[CH:46]=[CH:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[O:54]=[C:55]([CH:56]=[CH:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1)[CH:64]=[CH:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1.[O:72]=[C:73]([CH:74]=[CH:75][c:76]1[cH:77][cH:78][cH:79][cH:80][cH:81]1)[CH:82]=[CH:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1.[Pd:34].[Pd:35]>>[CH3:1][N:2]1[CH2:3][c:4]2[n:5]([n:8][c:9]([NH:11][c:13]3[c:14](=[O:21])[n:15]([CH3:20])[cH:16][c:17]([Br:19])[cH:18]3)[cH:10]2)[CH2:6][CH2:7]1