EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:107376 - 2-(benzenesulfonyl)-3-[9-methyl-2-(4-methyl-1-piperazinyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenenitrile

ChEBI IDCHEBI:107376
ChEBI Name2-(benzenesulfonyl)-3-[9-methyl-2-(4-methyl-1-piperazinyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenenitrile
Stars
DownloadsMolfile
FormulaC23H23N5O3S
Net Charge0
Average Mass449.536
Monoisotopic Mass449.15216
SMILESCc1cccn2c(=O)c(C=C(C#N)S(=O)(=O)c3ccccc3)c(N3CCN(C)CC3)nc12
InChIInChI=1S/C23H23N5O3S/c1-17-7-6-10-28-21(17)25-22(27-13-11-26(2)12-14-27)20(23(28)29)15-19(16-24)32(30,31)18-8-4-3-5-9-18/h3-10,15H,11-14H2,1-2H3
InChIKeyVEBZEIIKHSMIHX-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
2-(benzenesulfonyl)-3-[9-methyl-2-(4-methyl-1-piperazinyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenenitrile (CHEBI:107376) is a N-arylpiperazine (CHEBI:46848)
Manual XrefsDatabases
LSM-18730LINCS