HRID2202770

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID118343005

未命名化合物

结构：CCOC(=O)[C@H]1CC[C@H](n2ncc(C(=O)O)c2C(F)(F)F)C[C@H]1C

HCID118349845

未命名化合物

PRODUCTS

生成物

结构：COc1ncc(Cl)c(CCN(CC(C)(C)C)C(=O)c2cnn([C@H]3CC[C@H](C(=O)O)[C@H](C)C3)c2C(F)(F)F)c1Cl

HCID118383540

未命名化合物

PROCEDURE

实验过程

The title compound was prepared from N-(2-(3,5-dichloro-2-methoxypyridin-4-yl)ethyl)-2,2-dimethylpropan-1-amine and 1-((1S,3R,4S)-4-(ethoxycarbonyl)-3-methylcyclohexyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid by procedures similar to those described in example 872. MS (ESI) 593.2, 595.1 [M+H]+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-07a94610856049f7ba2773512bef7d73
来源数据集: uspto-grants-2016_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09365522B2
来源说明: uspto-grants-2016_06

反应 SMILES

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