HRID829912

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID105144

Palladium(2+)

Pd+2

结构：CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1

HCID11155794

2-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenyl

C33H49P

HCID13530704

2-Chloro-5-fluoro-4-methoxypyrimidine

C5H4ClFN2O

HCID57411799

未命名化合物

PRODUCTS

生成物

结构：COc1nc(N2CCn3nc(COc4ccccc4)cc3C2=O)ncc1F

HCID67974518

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7f24f12b67054b089e573c0fa0d1ede6
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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