HRID505064

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)CNCC(C)(C)n1cnc([N+](=O)[O-])c1

HCID67164086

未命名化合物

结构：O=C(Cc1cc(F)cc(F)c1)N[C@H](C(=O)O)c1ccc(F)cc1

HCID68463343

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)CNCC(C)(C)n1cnc(NC(=O)C(NC(=O)Cc2cc(F)cc(F)c2)c2ccc(F)cc2)c1

HCID16113687

未命名化合物

PROCEDURE

实验过程

2-methyl-N-neopentyl-2-(4-nitro-1H-imidazol-1-yl)propan-1-amine (U.S. Ser. No. 11/078,898 filed Mar. 11, 2005) was reduced and coupled with (S)-2-(2-(3,5-difluorophenyl)acetamido)-2-(4-fluorophenyl)acetic acid to afford the title compound: MS 530 m/z (M+1).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-635abc6603d1447a9125f8f7403a9c6a
来源数据集: uspto-grants-2010_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07781435B2
来源说明: uspto-grants-2010_08

反应 SMILES

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