HRID293622

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID5975

Cyanide

CN-

2 次

HCID6228

Dimethylformamide

C3H7NO

HCID23938

Palladium

2 次

HCID32051

Zinc (II) cation

Zn+2

HCID95417

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

C17H14O

3 次

HCID22260993

未命名化合物

PRODUCTS

产物

HCID22261035

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5dee36708d6540d0b20ac5a018edae2c
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:1][c:2]1[c:3]([O:18][CH3:19])[cH:4][c:5]([F:17])[c:6]([C:8](=[O:9])[c:10]2[cH:11][c:12]([F:16])[cH:13][cH:14][cH:15]2)[cH:7]1.[C-:26]#[N:27].[C-:29]#[N:30].[CH3:21][N:22]([CH3:23])[CH:24]=[O:25].[O:33]=[C:34]([CH:35]=[CH:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)[CH:43]=[CH:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[O:51]=[C:52]([CH:53]=[CH:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1)[CH:61]=[CH:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[O:69]=[C:70]([CH:71]=[CH:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1)[CH:79]=[CH:80][c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1.[OH2:20].[Pd:31].[Pd:32].[Zn+2:28]>>[c:2]1([C:21]#[N:22])[c:3]([O:18][CH3:19])[cH:4][c:5]([F:17])[c:6]([C:8](=[O:9])[c:10]2[cH:11][c:12]([F:16])[cH:13][cH:14][cH:15]2)[cH:7]1