HRID1540065

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID32051

Zinc (II) cation

Zn+2

HCID66111

Trimethylsilylacetylene

C5H10Si

HCID40161431

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)C#Cc1ccc(F)c(CNS(C)(=O)=O)c1

HCID67047541

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-37f66960be53432a87666a4ce4dda349
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

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