HRID1778142

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID688292

2-Fluoro-5-(trifluoromethyl)benzoic acid

C8H4F4O2

结构：COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(C#Cc2cccc(N)c2)c1

HCID118130063

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(C#Cc2cccc(NC(=O)c3cc(C(F)(F)F)ccc3F)c2)c1

HCID118130082

未命名化合物

PROCEDURE

实验过程

In a manner similar to that described in Example 25, methyl 5-[N-({6-amino-5-[(3-aminophenyl)ethynyl]pyridin-3-yl}carbonyl)-S-methylsulfonimidoyl]pentanoate and 2-fluoro-5-(trifluoromethyl)benzoic acid were coupled to give the title compound as a white foam (74 mg).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4b68c62f0a6e48d3ac8a8657352ceae9
来源数据集: uspto-grants-2016_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09266869B2
来源说明: uspto-grants-2016_02

反应 SMILES

[NH2:1][C:2]1[N:7]=[CH:6][C:5]([C:8]([N:10]=[S:11]([CH2:14][CH2:15][CH2:16][CH2:17][C:18]([O:20][CH3:21])=[O:19])([CH3:13])=[O:12])=[O:9])=[CH:4][C:3]=1[C:22]#[C:23][C:24]1[CH:29]=[CH:28][CH:27]=[C:26]([NH2:30])[CH:25]=1.[F:31][C:32]1[CH:40]=[CH:39][C:38]([C:41]([F:44])([F:43])[F:42])=[CH:37][C:33]=1[C:34](O)=[O:35]>>[NH2:1][C:2]1[N:7]=[CH:6][C:5]([C:8]([N:10]=[S:11]([CH2:14][CH2:15][CH2:16][CH2:17][C:18]([O:20][CH3:21])=[O:19])([CH3:13])=[O:12])=[O:9])=[CH:4][C:3]=1[C:22]#[C:23][C:24]1[CH:29]=[CH:28][CH:27]=[C:26]([NH:30][C:34](=[O:35])[C:33]2[CH:37]=[C:38]([C:41]([F:42])([F:43])[F:44])[CH:39]=[CH:40][C:32]=2[F:31])[CH:25]=1