EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:158799 - 3-methyl-1-oxo-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,5-dihydrobenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile

Default Structure
ChEBI IDCHEBI:158799
ChEBI Name3-methyl-1-oxo-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,5-dihydrobenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
Stars
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H20N4O2
Net Charge0
Average Mass348.406
Monoisotopic Mass348.15863
SMILESCc1c(CCC(=O)N2CCCC2)c(=O)n2c(nc3ccccc32)c1C#N
InChIInChI=1S/C20H20N4O2/c1-13-14(8-9-18(25)23-10-4-5-11-23)20(26)24-17-7-3-2-6-16(17)22-19(24)15(13)12-21/h2-3,6-7,22H,4-5,8-11H2,1H3
InChIKeyAEVYTKKOGUOZJH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-methyl-1-oxo-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,5-dihydrobenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile (CHEBI:158799) is a organic molecular entity (CHEBI:50860)
UniProt Name  Source
3-methyl-1-oxo-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,5-dihydrobenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrileUniProt
Citations