4'-{1-[4-(1,4-Dioxaspiro[4.5]dec-8-yl)-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethyl}biphenyl-2-carbonitrile

HCID 67009699

ノート反応

部分構造検索類似構造を探す

基本情報

標準SMILES: CCCc1c(C(C)c2ccc(-c3ccccc3C#N)cc2)c(=O)n(C2CCC3(CC2)OCCO3)c2ncnn12
InChIKey: LSJRNXUANRSCBD-UHFFFAOYSA-N
分子式: C31H33N5O3
平均分子量: 523.6 g/mol
単同位体質量: 523.25833993

名称と識別子

優先名称: 4'-{1-[4-(1,4-Dioxaspiro[4.5]dec-8-yl)-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethyl}biphenyl-2-carbonitrile
IUPAC: 2-[4-[1-[4-(1,4-dioxaspiro[4.5]decan-8-yl)-5-oxo-7-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethyl]phenyl]benzonitrile

名称と別名

SCHEMBL1372901LSJRNXUANRSCBD-UHFFFAOYSA-N4'-{1-[4-(1,4-dioxaspiro[4.5]dec-8-yl)-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethyl}biphenyl-2-carbonitrile