HRID859437

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)OC(=O)Nc1ccc(C#Cc2ccccc2)cc1N

HCID11404065

1,1-Dimethylethyl N-[2-amino-4-(2-phenylethynyl)phenyl]carbamate

C19H20N2O2

结构：Cc1cn(-c2cccc(C(=O)CC(=O)OC(C)(C)C)c2)c(C)n1

HCID69592806

未命名化合物

PRODUCTS

生成物

结构：Cc1cn(-c2cccc(C(=O)CC(=O)Nc3cc(C#Cc4ccccc4)ccc3NC(=O)OC(C)(C)C)c2)c(C)n1

HCID86588045

未命名化合物

PROCEDURE

实验过程

Prepared from (2-amino-4-phenylethynyl-phenyl)-carbamic acid tert.-butyl ester (Example G2) (231 mg, 0.75 mmol) and 3-[3-(2,4-dimethyl-imidazol-1-yl)-phenyl]-3-oxo-propionic acid tert.-butyl ester (Example H9) (157 mg, 0.5 mmol) according to the general procedure K. Obtained as a yellow amorphous substance (140 mg).

WORKUP

后处理

customObtained as a yellow amorphous substance (140 mg)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-26603bea8984474e8f2255bcaa9a0756
来源数据集: uspto-grants-2006_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07151098B2
来源说明: uspto-grants-2006_12

反应 SMILES

[C:1]([O:5][C:6](=[O:23])[NH:7][C:8]1[CH:13]=[CH:12][C:11]([C:14]#[C:15][C:16]2[CH:21]=[CH:20][CH:19]=[CH:18][CH:17]=2)=[CH:10][C:9]=1[NH2:22])([CH3:4])([CH3:3])[CH3:2].C([O:28][C:29](=O)[CH2:30][C:31]([C:33]1[CH:38]=[CH:37][CH:36]=[C:35]([N:39]2[CH:43]=[C:42]([CH3:44])[N:41]=[C:40]2[CH3:45])[CH:34]=1)=[O:32])(C)(C)C>>[C:1]([O:5][C:6](=[O:23])[NH:7][C:8]1[CH:13]=[CH:12][C:11]([C:14]#[C:15][C:16]2[CH:17]=[CH:18][CH:19]=[CH:20][CH:21]=2)=[CH:10][C:9]=1[NH:22][C:29](=[O:28])[CH2:30][C:31]([C:33]1[CH:38]=[CH:37][CH:36]=[C:35]([N:39]2[CH:43]=[C:42]([CH3:44])[N:41]=[C:40]2[CH3:45])[CH:34]=1)=[O:32])([CH3:4])([CH3:2])[CH3:3]