HRID304357

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID19660

Carbonate

CO3-2

HCID24290

未命名化合物

HCID31275

1,4-Dioxane

C4H8O2

HCID13024027

5-Bromo-1-methylpyridin-2(1H)-one

C6H6BrNO

结构：C=C(C)CC1(c2ccccc2)CCCN(C(C)c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)C(=O)N1

HCID178440553

未命名化合物

PRODUCTS

生成物

结构：C=C(C)CC1(c2ccccc2)CCCN(C(C)c2ccc(-c3ccc(=O)n(C)c3)cc2)C(=O)N1

HCID178440556

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-89271a44086d4ecda717e8a025050405
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:36][c:37]1[cH:38][cH:39][c:40](=[O:44])[n:41]([CH3:43])[cH:42]1.[C:45](=[O:46])([O-:47])[O-:48].[CH2:92]1[O:93][CH2:94][CH2:95][O:96][CH2:97]1.[CH3:1][C:2]([CH2:3][C:4]1([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[NH:5][C:6](=[O:28])[N:7]([CH:11]([CH3:12])[c:13]2[cH:14][cH:15][c:16]([B:19]3[O:20][C:21]([CH3:22])([CH3:23])[C:24]([CH3:25])([CH3:26])[O:27]3)[cH:17][cH:18]2)[CH2:8][CH2:9][CH2:10]1)=[CH2:35].[Na+:49].[Na+:50].[Pd:51]([Cl:52])[Cl:53].[c:54]1([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:73]1([P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[cH:87][cH:88][cH:89][cH:90][cH:91]1>>[CH3:1][C:2]([CH2:3][C:4]1([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[NH:5][C:6](=[O:28])[N:7]([CH:11]([CH3:12])[c:13]2[cH:14][cH:15][c:16](-[c:37]3[cH:38][cH:39][c:40](=[O:44])[n:41]([CH3:43])[cH:42]3)[cH:17][cH:18]2)[CH2:8][CH2:9][CH2:10]1)=[CH2:35]