HRID1908279

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1415528

1-(1,3-Benzoxazol-2-yl)methanamine

C8H8N2O

结构：O=C(NC(Cc1ccccc1)C(O)C(=O)O)c1cccnc1-n1ccc(-c2ccccc2)n1

HCID67238194

未命名化合物

PRODUCTS

生成物

结构：O=C(NC(Cc1ccccc1)C(O)C(=O)NCc1nc2ccccc2o1)c1cccnc1-n1ccc(-c2ccccc2)n1

HCID67240594

未命名化合物

PROCEDURE

实验过程

The reaction was carried out in analogy to reaction step 1.3 by reacting 4-phenyl-2-hydroxy-3-(2-(3-phenyl-1H-pyrazol-1-yl)nicotinamido)butanoic acid with benzo[d]oxazol-2-ylmethylamine; ESI-MS [M+H]+: 573.2

WORKUP

后处理

customThe reaction was carried out in analogy to reaction step 1.3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7cdedc59bf2a4049a313f04c28566509
来源数据集: uspto-grants-2013_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08598211B2
来源说明: uspto-grants-2013_12

反应 SMILES

[C:1]1([CH2:7][CH:8]([NH:14][C:15](=[O:33])[C:16]2[CH:21]=[CH:20][CH:19]=[N:18][C:17]=2[N:22]2[CH:26]=[CH:25][C:24]([C:27]3[CH:32]=[CH:31][CH:30]=[CH:29][CH:28]=3)=[N:23]2)[CH:9]([OH:13])[C:10]([OH:12])=O)[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[O:34]1[C:38]2[CH:39]=[CH:40][CH:41]=[CH:42][C:37]=2[N:36]=[C:35]1[CH2:43][NH2:44]>>[O:34]1[C:38]2[CH:39]=[CH:40][CH:41]=[CH:42][C:37]=2[N:36]=[C:35]1[CH2:43][NH:44][C:10](=[O:12])[CH:9]([OH:13])[CH:8]([NH:14][C:15](=[O:33])[C:16]1[CH:21]=[CH:20][CH:19]=[N:18][C:17]=1[N:22]1[CH:26]=[CH:25][C:24]([C:27]2[CH:28]=[CH:29][CH:30]=[CH:31][CH:32]=2)=[N:23]1)[CH2:7][C:1]1[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1