HRID282396

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID2734215

2-(Di-tert-butylphosphino)biphenyl

C20H27P

HCID4574913

未命名化合物

HCID39616691

未命名化合物

HCID86689009

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NC(C)(C)c1ccc(N2CC(Oc3ccc(OCC4CC4)cc3)C2)cc1

HCID86689031

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-05dd1e7262784845a2e05aa18950a863
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:17][c:18]1[cH:19][cH:20][c:21]([C:24]([CH3:25])([CH3:26])[NH:27][C:28]([CH3:29])=[O:30])[cH:22][cH:23]1.[C:37]([P:38]([C:39]([CH3:40])([CH3:41])[CH3:42])[c:43]1[cH:44][cH:45][cH:46][cH:47][c:48]1-[c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)([CH3:55])([CH3:56])[CH3:57].[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:31][C:32]([CH3:33])([O-:34])[CH3:35].[CH:101](=[CH:102][C:103]([CH:104]=[CH:105][c:106]1[cH:107][cH:108][cH:109][cH:110][cH:111]1)=[O:112])[c:113]1[cH:114][cH:115][cH:116][cH:117][cH:118]1.[CH:1]1([CH2:4][O:5][c:6]2[cH:7][cH:8][c:9]([O:10][CH:11]3[CH2:12][NH:13][CH2:14]3)[cH:15][cH:16]2)[CH2:2][CH2:3]1.[CH:65](=[CH:66][C:67]([CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)=[O:76])[c:77]1[cH:78][cH:79][cH:80][cH:81][cH:82]1.[CH:83](=[CH:84][C:85]([CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1)=[O:94])[c:95]1[cH:96][cH:97][cH:98][cH:99][cH:100]1.[Na+:36].[Pd:63].[Pd:64]>>[CH:1]1([CH2:4][O:5][c:6]2[cH:7][cH:8][c:9]([O:10][CH:11]3[CH2:12][N:13]([c:18]4[cH:19][cH:20][c:21]([C:24]([CH3:25])([CH3:26])[NH:27][C:28]([CH3:29])=[O:30])[cH:22][cH:23]4)[CH2:14]3)[cH:15][cH:16]2)[CH2:2][CH2:3]1