HRID1544598

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID23938

Palladium

HCID10911901

6-(5-Bromo-furan-2-yl)-nicotinonitrile

C10H5BrN2O

HCID178509807

未命名化合物

PRODUCTS

生成物

结构：N#Cc1ccc(Cc2ccc(-c3ccc(C#N)cn3)o2)cc1

HCID10946029

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df0003115e4e4e77b500b11308048206
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-:15].[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:7]2[n:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]2)[o:6]1.[C:16](#[N:17])[c:18]1[cH:19][cH:20][c:21]([CH2:22][Zn+:23])[cH:24][cH:25]1.[Cl:31][CH2:32][Cl:33].[O:26]1[CH2:27][CH2:28][CH2:29][CH2:30]1.[Pd:110].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1.[c:72]1([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[cH:86][cH:87][cH:88][cH:89][cH:90]1.[c:91]1([P:92]([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)[cH:105][cH:106][cH:107][cH:108][cH:109]1>>[c:2]1([CH2:22][c:21]2[cH:20][cH:19][c:18]([C:16]#[N:17])[cH:25][cH:24]2)[cH:3][cH:4][c:5](-[c:7]2[n:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]2)[o:6]1