HRID1260955

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2783372

4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylic acid

C12H7F3O2S

结构：CN[C@@H]1CCN(C(=O)C2CCN(C(C)=O)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1

HCID57741761

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3cc(-c4ccccc4)c(C(F)(F)F)s3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1

HCID68936609

未命名化合物

PROCEDURE

实验过程

Using the compound obtained in Example 78 and 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylic acid, and by the reaction and purification in the same manner as in Example 3, the title compound was obtained.

WORKUP

后处理

customby the reaction and purification in the same manner as in Example 3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b546df18e9f74ed29dc9fd7eaba47938
来源数据集: uspto-grants-2013_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08470816B2
来源说明: uspto-grants-2013_06

反应 SMILES

[C:1]([N:4]1[CH2:9][CH2:8][CH:7]([C:10]([N:12]2[CH2:17][CH2:16][C@@H:15]([NH:18][CH3:19])[C@H:14]([C:20]3[CH:25]=[CH:24][C:23]([Cl:26])=[C:22]([Cl:27])[CH:21]=3)[CH2:13]2)=[O:11])[CH2:6][CH2:5]1)(=[O:3])[CH3:2].[C:28]1([C:34]2[CH:35]=[C:36]([C:43]([OH:45])=O)[S:37][C:38]=2[C:39]([F:42])([F:41])[F:40])[CH:33]=[CH:32][CH:31]=[CH:30][CH:29]=1>>[C:1]([N:4]1[CH2:5][CH2:6][CH:7]([C:10]([N:12]2[CH2:17][CH2:16][C@@H:15]([N:18]([CH3:19])[C:43]([C:36]3[S:37][C:38]([C:39]([F:40])([F:41])[F:42])=[C:34]([C:28]4[CH:29]=[CH:30][CH:31]=[CH:32][CH:33]=4)[CH:35]=3)=[O:45])[C@H:14]([C:20]3[CH:25]=[CH:24][C:23]([Cl:26])=[C:22]([Cl:27])[CH:21]=3)[CH2:13]2)=[O:11])[CH2:8][CH2:9]1)(=[O:3])[CH3:2]