HRID1567302

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID23938

Palladium

2 次

HCID66111

Trimethylsilylacetylene

C5H10Si

HCID83717

Copper iodide (CuI2)

CuI2

HCID95417

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

C17H14O

3 次

HCID521585

Tri(2-furyl)phosphine

C12H9O3P

HCID23404137

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)C#Cc1ccc(N2CC(Cn3ccnn3)OC2=O)cc1F

HCID18438598

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d75b45f0f9c240c2a2223c5c451aa2ab
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:109][N:110]1[CH2:111][CH2:112][CH2:113][C:114]1=[O:115].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:44][Si:45]([CH3:46])([CH3:47])[C:48]#[CH:49].[Cu:106]([I:107])[I:108].[F:1][c:2]1[cH:3][c:4]([N:9]2[C:10](=[O:20])[O:11][CH:12]([CH2:14][n:15]3[n:16][n:17][cH:18][cH:19]3)[CH2:13]2)[cH:5][cH:6][c:7]1[I:8].[O:116]1[CH2:117][CH2:118][CH2:119][CH2:120]1.[O:52]=[C:53]([CH:54]=[CH:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1)[CH:62]=[CH:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[O:70]=[C:71]([CH:72]=[CH:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1)[CH:80]=[CH:81][c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1.[O:88]=[C:89]([CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1)[CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1.[Pd:50].[Pd:51].[o:21]1[cH:22][cH:23][cH:24][c:25]1[P:26]([c:27]1[o:28][cH:29][cH:30][cH:31]1)[c:32]1[o:33][cH:34][cH:35][cH:36]1>>[F:1][c:2]1[cH:3][c:4]([N:9]2[C:10](=[O:20])[O:11][CH:12]([CH2:14][n:15]3[n:16][n:17][cH:18][cH:19]3)[CH2:13]2)[cH:5][cH:6][c:7]1[C:49]#[C:48][Si:45]([CH3:44])([CH3:46])[CH3:47]