HRID698837

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID7502

4-Vinylpyridine

C7H7N

HCID8471

Triethylamine

C6H15N

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

HCID105144

Palladium(2+)

Pd+2

反应SMILES：CC(C)(C)c1ccc(N2Cc3cccc(Br)c3C2=O)cc1

HCID69031710

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)(C)c1ccc(N2Cc3cccc(C=Cc4ccncc4)c3C2=O)cc1

HCID69031065

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-168e0a4455a349f29a2d6d003e20a80c
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

[Br:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:10]1[C:9](=[O:11])[N:8]([c:12]1[cH:13][cH:14][c:15]([C:18]([CH3:19])([CH3:20])[CH3:21])[cH:16][cH:17]1)[CH2:7]2.[CH3:61][CH2:62][N:63]([CH2:64][CH3:65])[CH2:66][CH3:67].[CH:22](=[CH2:23])[c:24]1[cH:25][cH:26][n:27][cH:28][cH:29]1.[O-:53][C:54]([CH3:55])=[O:56].[O-:57][C:58]([CH3:59])=[O:60].[Pd+2:52].[c:30]1([CH3:31])[cH:32][cH:33][cH:34][cH:35][c:36]1[P:37]([c:38]1[cH:39][cH:40][cH:41][cH:42][c:43]1[CH3:44])[c:45]1[cH:46][cH:47][cH:48][cH:49][c:50]1[CH3:51]>>[c:2]1([CH:23]=[CH:22][c:24]2[cH:25][cH:26][n:27][cH:28][cH:29]2)[cH:3][cH:4][cH:5][c:6]2[c:10]1[C:9](=[O:11])[N:8]([c:12]1[cH:13][cH:14][c:15]([C:18]([CH3:19])([CH3:20])[CH3:21])[cH:16][cH:17]1)[CH2:7]2