HRID56700

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C(=O)O)n1cc(Cl)c(-c2cc(Cl)ccc2C#N)cc1=O

HCID117622549

2-[5-Chloro-4-(5-chloro-2-cyanophenyl)-2-oxopyridin-1(2H)-yl]propanoic acid

C15H10Cl2N2O3

结构：CC(C)(C)OC(=O)n1[nH]c(=O)cc1-c1ccc(N)cc1

HCID117622554

未命名化合物

PRODUCTS

生成物

结构：CC(C(=O)Nc1ccc(-c2cc(=O)[nH]n2C(=O)OC(C)(C)C)cc1)n1cc(Cl)c(-c2cc(Cl)ccc2C#N)cc1=O

HCID117622708

未命名化合物

PROCEDURE

实验过程

150 mg (purity 82%, 0.37 mmol) of 2-[5-chloro-4-(5-chloro-2-cyanophenyl)-2-oxopyridin-1(2H)-yl]propanoic acid (racemate) and 1.2 eq. of tert-butyl 5-(4-aminophenyl)-3-oxo-2,3-dihydro-1H-pyrazole-1-carboxylate were reacted according to General Method 5A. Yield: 17.8 mg (purity 78%, 6% of theory)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bd90f44898e747ba996e95857f7bdcf9
来源数据集: uspto-grants-2016_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09434690B2
来源说明: uspto-grants-2016_09

反应 SMILES

[Cl:1][C:2]1[C:3]([C:14]2[CH:19]=[C:18]([Cl:20])[CH:17]=[CH:16][C:15]=2[C:21]#[N:22])=[CH:4][C:5](=[O:13])[N:6]([CH:8]([CH3:12])[C:9](O)=[O:10])[CH:7]=1.[NH2:23][C:24]1[CH:29]=[CH:28][C:27]([C:30]2[N:34]([C:35]([O:37][C:38]([CH3:41])([CH3:40])[CH3:39])=[O:36])[NH:33][C:32](=[O:42])[CH:31]=2)=[CH:26][CH:25]=1>>[Cl:1][C:2]1[C:3]([C:14]2[CH:19]=[C:18]([Cl:20])[CH:17]=[CH:16][C:15]=2[C:21]#[N:22])=[CH:4][C:5](=[O:13])[N:6]([CH:8]([CH3:12])[C:9]([NH:23][C:24]2[CH:29]=[CH:28][C:27]([C:30]3[N:34]([C:35]([O:37][C:38]([CH3:40])([CH3:39])[CH3:41])=[O:36])[NH:33][C:32](=[O:42])[CH:31]=3)=[CH:26][CH:25]=2)=[O:10])[CH:7]=1