HRID2138386

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID79304

Methanone, diphenyl-, hydrazone

C13H12N2

HCID105144

Palladium(2+)

Pd+2

反应SMILES：c1ccc(P(c2ccccc2)c2ccc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1

HCID634876

2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl

C44H32P2

HCID736487

5-Bromoisoquinoline

C9H6BrN

HCID4574913

未命名化合物

PRODUCTS

产物

反应SMILES：c1ccc(C(=NNc2cccc3cnccc23)c2ccccc2)cc1

HCID59226081

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-878bda8d012544a7aa16944d076657f9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[Br:1][c:2]1[c:3]2[cH:4][cH:5][n:6][cH:7][c:8]2[cH:9][cH:10][cH:11]1.[C:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)=[N:25][NH2:26].[C:86]([O-:87])(=[O:88])[CH3:89].[C:90]([O-:91])(=[O:92])[CH3:93].[CH3:73][C:74]([CH3:75])([O-:76])[CH3:77].[CH3:79][c:80]1[cH:81][cH:82][cH:83][cH:84][cH:85]1.[Na+:78].[Pd+2:94].[c:27]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][c:38]3[c:39]([cH:40][cH:41][cH:42][cH:43]3)[c:44]2-[c:45]2[c:46]3[c:47]([cH:48][cH:49][cH:50][cH:51]3)[cH:52][cH:53][c:54]2[P:55]([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[cH:68][cH:69][cH:70][cH:71][cH:72]1>>[c:2]1([NH:26][N:25]=[C:12]([c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:3]2[cH:4][cH:5][n:6][cH:7][c:8]2[cH:9][cH:10][cH:11]1