(S)-4-(4-((6-oxo-6,6a,7,8-tetrahydro-5H-azeto[1,2-a]pyrido[3,2-e]pyrazin-3-yl)methyl)piperazin-1-yl)benzonitrile

HCID 58324460

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: N#Cc1ccc(N2CCN(Cc3cnc4c(c3)NC(=O)[C@@H]3CCN43)CC2)cc1
InChIKey: CKGPVOCSMDTBML-IBGZPJMESA-N
分子式: C21H22N6O
平均分子量: 374.4 g/mol

名称と識別子

優先名称: (S)-4-(4-((6-oxo-6,6a,7,8-tetrahydro-5H-azeto[1,2-a]pyrido[3,2-e]pyrazin-3-yl)methyl)piperazin-1-yl)benzonitrile
IUPAC: 4-[4-[[(5S)-6-oxo-2,7,12-triazatricyclo[6.4.0.02,5]dodeca-1(8),9,11-trien-10-yl]methyl]piperazin-1-yl]benzonitrile

名称と別名

SCHEMBL710453CKGPVOCSMDTBML-IBGZPJMESA-N(S)-4-(4-((6-oxo-6,6a,7,8-tetrahydro-5H-azeto[1,2-a]pyrido[3,2-e]pyrazin-3-yl)methyl)piperazin-1-yl)benzonitrile