HRID1917114

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID75257

Benzoyl chloride, 3-(trifluoromethyl)-

C8H4ClF3O

HCID33781065

未命名化合物

PRODUCTS

生成物

结构：Cn1nc(N2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)c(=O)n(C)c1=O

HCID58269768

未命名化合物

结构：Cn1nc(N2CCN(C(=O)c3cc(C(F)(F)F)ccc3C(F)(F)F)CC2)c(=O)n(C)c1=O

HCID58269815

未命名化合物

收率 75%

PROCEDURE

实验过程

The compound 44 (solid) is prepared from 3-trifluoromethyl-benzoyl chloride and from the intermediate 12a according to the synthesis method 2 under the operating conditions described for Example 40 (yield: 75%).

WORKUP

后处理

customaccording to the synthesis method 2 under the operating conditions

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6100cc984e2343cebc5f70cbb0fc3e7c
来源数据集: uspto-grants-2013_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08618287B2
来源说明: uspto-grants-2013_12

反应 SMILES

[F:1][C:2]([F:13])([F:12])[C:3]1[CH:4]=[C:5]([CH:9]=[CH:10][CH:11]=1)[C:6](Cl)=[O:7].[CH3:14][N:15]1[C:20](=[O:21])[N:19]([CH3:22])[C:18](=[O:23])[C:17]([N:24]2[CH2:29][CH2:28][NH:27][CH2:26][CH2:25]2)=[N:16]1>>[CH3:14][N:15]1[C:20](=[O:21])[N:19]([CH3:22])[C:18](=[O:23])[C:17]([N:24]2[CH2:25][CH2:26][N:27]([C:6](=[O:7])[C:5]3[CH:9]=[CH:10][CH:11]=[C:3]([C:2]([F:13])([F:12])[F:1])[CH:4]=3)[CH2:28][CH2:29]2)=[N:16]1.[F:1][C:2]([F:13])([F:12])[C:9]1[CH:10]=[CH:11][C:3]([C:2]([F:13])([F:12])[F:1])=[CH:4][C:5]=1[C:6]([N:27]1[CH2:26][CH2:25][N:24]([C:17]2[C:18](=[O:23])[N:19]([CH3:22])[C:20](=[O:21])[N:15]([CH3:14])[N:16]=2)[CH2:29][CH2:28]1)=[O:7]