HRID678466

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID7515

N-Methylaniline

C7H9N

HCID23938

Palladium

2 次

HCID32883

Benzene, 2-chloro-1,4-dimethyl-

C8H9Cl

HCID95417

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

C17H14O

3 次

PRODUCTS

生成物

HCID11042050

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3a43b0b5fcac474e8f081c9e11b3706a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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