HRID880739

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COC(=O)[C@@H]1C[C@H](O)CCN1C(=O)OCc1ccccc1

HCID14890235

未命名化合物

结构：COC(=O)C1CC(Oc2cc(-c3nc(C(F)(F)F)cs3)nc3c(C)c(OC)ccc23)CCN1C(=O)OCc1ccccc1

HCID66730320

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CC(Oc2nc(-c3nc(C(F)(F)F)cs3)nc3c(C)c(OC)ccc23)CCN1C

HCID66730327

未命名化合物

收率 60%

PROCEDURE

实验过程

Compound 22 was synthesized from compounds 12 and 206 as a yellow powder in 60% yield according to the procedure as described for compound 13. MS (ESI, EI+) m/z=617 (MH+).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-496eedbbf6ca48c3b41a09e71c13d159
来源数据集: uspto-grants-2015_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08993595B2
来源说明: uspto-grants-2015_03

反应 SMILES

O[C@@H]1CC[N:5](C(OCC2C=CC=CC=2)=O)[C@H](C(OC)=O)C1.[CH3:22][O:23][C:24]([CH:26]1[CH2:31][CH:30]([O:32][C:33]2[C:42]3[C:37](=[C:38]([CH3:45])[C:39]([O:43][CH3:44])=[CH:40][CH:41]=3)[N:36]=[C:35]([C:46]3[S:47][CH:48]=[C:49]([C:51]([F:54])([F:53])[F:52])[N:50]=3)C=2)[CH2:29][CH2:28][N:27]1[C:55](OCC1C=CC=CC=1)=O)=[O:25]>>[CH3:22][O:23][C:24]([CH:26]1[CH2:31][CH:30]([O:32][C:33]2[C:42]3[C:37](=[C:38]([CH3:45])[C:39]([O:43][CH3:44])=[CH:40][CH:41]=3)[N:36]=[C:35]([C:46]3[S:47][CH:48]=[C:49]([C:51]([F:53])([F:52])[F:54])[N:50]=3)[N:5]=2)[CH2:29][CH2:28][N:27]1[CH3:55])=[O:25]