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CHEBI:228523 - 3-(4-benzyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)piperidin-2-one

ChEBI IDCHEBI:228523
ChEBI Name3-(4-benzyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)piperidin-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16N4OS
Net Charge0
Average Mass288.376
Monoisotopic Mass288.10448
SMILESO=C1NCCCC1c1nnc(=S)n1Cc1ccccc1
InChIInChI=1S/C14H16N4OS/c19-13-11(7-4-8-15-13)12-16-17-14(20)18(12)9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H,15,19)(H,17,20)
InChIKeyYRUUNGGUALOBJO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
3-(4-benzyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)piperidin-2-one (CHEBI:228523) is a tetrahydropyridine (CHEBI:26921)
IUPAC Name 
3-(4-benzyl-5-sulanylidene-1H-1,2,4-triazol-3-yl)piperidin-2-one
Manual XrefsDatabases
2075317ChemSpider