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CHEBI:123288 - 3-[9-methyl-2-(4-methyl-1-piperazinyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile

ChEBI IDCHEBI:123288
ChEBI Name3-[9-methyl-2-(4-methyl-1-piperazinyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile
Stars
DownloadsMolfile
FormulaC24H25N5O3S
Net Charge0
Average Mass463.563
Monoisotopic Mass463.16781
SMILESCc1ccc(S(=O)(=O)C(C#N)=Cc2c(N3CCN(C)CC3)nc3c(C)cccn3c2=O)cc1
InChIInChI=1S/C24H25N5O3S/c1-17-6-8-19(9-7-17)33(31,32)20(16-25)15-21-23(28-13-11-27(3)12-14-28)26-22-18(2)5-4-10-29(22)24(21)30/h4-10,15H,11-14H2,1-3H3
InChIKeyHRZIKHFUKPSGLA-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)
3-[9-methyl-2-(4-methyl-1-piperazinyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile (CHEBI:123288) is a N-arylpiperazine (CHEBI:46848)
Manual XrefsDatabases
LSM-34730LINCS