HRID625453

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID28162916

未命名化合物

结构：CCN(CC)c1ccc(NC(=O)c2cccc(C(=O)N(C)CCOCCOCCOCCC(=O)OC(C)(C)C)c2)c(-c2cc(C(=O)NCc3cccc(C(F)(F)F)c3)ccn2)c1

HCID66586842

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)c1ccc(NC(=O)c2cccc(C(=O)N3CCC[C@H](C(=O)NCCOC)C3)c2)c(-c2cc(C(=O)NCc3cccc(C(F)(F)F)c3)ccn2)c1

HCID86705968

未命名化合物

PROCEDURE

实验过程

This compound was prepared according to the procedure described for the synthesis of tert-butyl 1-(3-((4-(diethylamino)-2-(4-((3-(trifluoromethyl)benzyl)carbamoyl)pyridin-2-yl)phenyl)carbamoyl)phenyl)-2-methyl-1-oxo-5,8,11-trioxa-2-azatetradecan-14-oate Example 188, using (S)—N-(2-methoxyethyl)piperidine-3-carboxamide 4.14a in place of tert-butyl 5,8,11-trioxa-2-azatetradecan-14-oate. MS (ES, m/z): 759.4 [M+H]+.

WORKUP

后处理

customThis compound was prepared

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7f7733a04d8f4044a8f63516996ab623
来源数据集: uspto-grants-2016_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09301951B2
来源说明: uspto-grants-2016_04

反应 SMILES

[CH2:1]([N:3]([CH2:61][CH3:62])[C:4]1[CH:9]=[CH:8][C:7]([NH:10][C:11]([C:13]2[CH:14]=[C:15]([C:19](=[O:40])[N:20]([CH3:39])CCOCCOCCOCCC(OC(C)(C)C)=O)[CH:16]=[CH:17][CH:18]=2)=[O:12])=[C:6]([C:41]2[CH:46]=[C:45]([C:47](=[O:60])[NH:48][CH2:49][C:50]3[CH:55]=[CH:54][CH:53]=[C:52]([C:56]([F:59])([F:58])[F:57])[CH:51]=3)[CH:44]=[CH:43][N:42]=2)[CH:5]=1)[CH3:2].[CH3:63][O:64][CH2:65][CH2:66][NH:67][C:68]([C@H:70]1[CH2:75][CH2:74][CH2:73]NC1)=[O:69]>>[CH2:1]([N:3]([CH2:61][CH3:62])[C:4]1[CH:9]=[CH:8][C:7]([NH:10][C:11](=[O:12])[C:13]2[CH:18]=[CH:17][CH:16]=[C:15]([C:19]([N:20]3[CH2:73][CH2:74][CH2:75][C@H:70]([C:68](=[O:69])[NH:67][CH2:66][CH2:65][O:64][CH3:63])[CH2:39]3)=[O:40])[CH:14]=2)=[C:6]([C:41]2[CH:46]=[C:45]([CH:44]=[CH:43][N:42]=2)[C:47]([NH:48][CH2:49][C:50]2[CH:55]=[CH:54][CH:53]=[C:52]([C:56]([F:59])([F:58])[F:57])[CH:51]=2)=[O:60])[CH:5]=1)[CH3:2]