HRID404106

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13388477

Ethyl 5-phenyl-1,3-oxazole-2-carboxylate

C12H11NO3

结构：COC(=O)[C@H](C(C)C)N1Cc2ccc(-c3ccc(NC(=O)c4ncc(-c5ccccc5)s4)cc3)cc2C1=O

HCID123332092

未命名化合物

结构：COC(=O)[C@H](C(C)C)N1Cc2ccc(-c3ccc(N)cn3)cc2C1=O

HCID131731548

未命名化合物

PRODUCTS

生成物

结构：COC(=O)[C@H](C(C)C)N1Cc2ccc(-c3ccc(NC(=O)c4ncc(-c5ccccc5)o4)cn3)cc2C1=O

HCID123156697

未命名化合物

收率 83%

PROCEDURE

实验过程

The compound of example 634 was prepared analogous to the compound of example 611 by reaction of compound of example 392 with ethyl 5-phenyloxazole-2-carboxylate.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-36470e9e9a5a4831884721b4eddf7652
来源数据集: uspto-grants-2014_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08748426B2
来源说明: uspto-grants-2014_06

反应 SMILES

CC(C)[C@H](N1CC2C(=CC(C3C=CC(NC(C4SC(C5C=CC=CC=5)=CN=4)=O)=CC=3)=CC=2)C1=O)C(OC)=O.[NH2:39][C:40]1[CH:41]=[CH:42][C:43]([C:46]2[CH:54]=[C:53]3[C:49]([CH2:50][N:51]([C@@H:56]([CH:61]([CH3:63])[CH3:62])[C:57]([O:59][CH3:60])=[O:58])[C:52]3=[O:55])=[CH:48][CH:47]=2)=[N:44][CH:45]=1.[C:64]1([C:70]2[O:74][C:73]([C:75](OCC)=[O:76])=[N:72][CH:71]=2)[CH:69]=[CH:68][CH:67]=[CH:66][CH:65]=1>>[CH3:62][CH:61]([CH3:63])[C@H:56]([N:51]1[CH2:50][C:49]2[C:53](=[CH:54][C:46]([C:43]3[CH:42]=[CH:41][C:40]([NH:39][C:75]([C:73]4[O:74][C:70]([C:64]5[CH:65]=[CH:66][CH:67]=[CH:68][CH:69]=5)=[CH:71][N:72]=4)=[O:76])=[CH:45][N:44]=3)=[CH:47][CH:48]=2)[C:52]1=[O:55])[C:57]([O:59][CH3:60])=[O:58]