HRID1410268

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)C(=O)[N-]Cc1ccc(C(F)(F)F)c(N=C=S)c1

HCID178447313

未命名化合物

结构：CNc1cc(OCC(F)F)c(C(=O)N[C@H]2CC[C@H](C(F)(F)F)CC2)cc1N

HCID178482270

未命名化合物

PRODUCTS

生成物

结构：Cn1c(Nc2cc(CNC(=O)C(C)(C)C)ccc2C(F)(F)F)nc2cc(C(=O)N[C@H]3CC[C@H](C(F)(F)F)CC3)c(OCC(F)F)cc21

HCID178481211

未命名化合物

收率 51%

PROCEDURE

实验过程

The sub-title compound was prepared from 5-amino-2-(2,2-difluoroethoxy)-4-(methylamino)-N-(trans-4-trifluoromethyl-cyclohex-1-yl)-benzamide and N-(3-isothiocyanato-4-trifluoromethyl-benzyl)-pivaloylamide in analogy to example 72a.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-92ee9df17a85494280ad956b071433c2
来源数据集: uspto-grants-2014_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08921405B2
来源说明: uspto-grants-2014_12

反应 SMILES

[NH2:1][C:2]1[C:3]([NH:26][CH3:27])=[CH:4][C:5]([O:21][CH2:22][CH:23]([F:25])[F:24])=[C:6]([CH:20]=1)[C:7]([NH:9][C@H:10]1[CH2:15][CH2:14][C@H:13]([C:16]([F:19])([F:18])[F:17])[CH2:12][CH2:11]1)=[O:8].[N:28]([C:31]1[CH:32]=[C:33]([CH:42]=[CH:43][C:44]=1[C:45]([F:48])([F:47])[F:46])[CH2:34][N-:35][C:36](=[O:41])[C:37]([CH3:40])([CH3:39])[CH3:38])=[C:29]=S>>[F:17][C:16]([F:18])([F:19])[C@H:13]1[CH2:14][CH2:15][C@H:10]([NH:9][C:7]([C:6]2[C:5]([O:21][CH2:22][CH:23]([F:24])[F:25])=[CH:4][C:3]3[N:26]([CH3:27])[C:29]([NH:28][C:31]4[CH:32]=[C:33]([CH2:34][NH:35][C:36]([C:37]([CH3:40])([CH3:39])[CH3:38])=[O:41])[CH:42]=[CH:43][C:44]=4[C:45]([F:48])([F:47])[F:46])=[N:1][C:2]=3[CH:20]=2)=[O:8])[CH2:11][CH2:12]1