HRID191109

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

2 次

HCID53167

1-Methylpiperazine

C5H12N2

HCID95417

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

C17H14O

3 次

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

HCID2734217

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

C26H36NP

HCID2779367

5-bromo-2-(trifluoromethoxy)aniline

C7H5BrF3NO

PRODUCTS

生成物

HCID24994142

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b9edcdd2e41f482ba40a6804cba7e63c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:29][c:30]1[cH:31][cH:32][c:33]([O:37][C:38]([F:39])([F:40])[F:41])[c:34]([NH2:36])[cH:35]1.[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:42][N:43]1[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]1.[CH:1]1([P:2]([CH:3]2[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2-[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[N:21]([CH3:22])[CH3:23])[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]1.[O:56]=[C:57]([CH:58]=[CH:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1)[CH:66]=[CH:67][c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1.[O:74]=[C:75]([CH:76]=[CH:77][c:78]1[cH:79][cH:80][cH:81][cH:82][cH:83]1)[CH:84]=[CH:85][c:86]1[cH:87][cH:88][cH:89][cH:90][cH:91]1.[O:92]=[C:93]([CH:94]=[CH:95][c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1)[CH:102]=[CH:103][c:104]1[cH:105][cH:106][cH:107][cH:108][cH:109]1.[Pd:54].[Pd:55]>>[c:30]1([N:46]2[CH2:45][CH2:44][N:43]([CH3:42])[CH2:48][CH2:47]2)[cH:31][cH:32][c:33]([O:37][C:38]([F:39])([F:40])[F:41])[c:34]([NH2:36])[cH:35]1