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CHEBI:194288 - 3-(allylsulfanyl)-4-[4-(benzyloxy)phenyl]-5-methyl-4H-1,2,4-triazole

ChEBI IDCHEBI:194288
ChEBI Name3-(allylsulfanyl)-4-[4-(benzyloxy)phenyl]-5-methyl-4H-1,2,4-triazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H19N3OS
Net Charge0
Average Mass337.448
Monoisotopic Mass337.12488
SMILESC=CCSc1nnc(C)n1-c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H19N3OS/c1-3-13-24-19-21-20-15(2)22(19)17-9-11-18(12-10-17)23-14-16-7-5-4-6-8-16/h3-12H,1,13-14H2,2H3
InChIKeyRHXWYCGZGKSRGG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) peripheral blood mononuclear cell (BTO:0001025) MetaboLights (MTBLS6661)
ChEBI Ontology
Outgoing Relation(s)
3-(allylsulfanyl)-4-[4-(benzyloxy)phenyl]-5-methyl-4H-1,2,4-triazole (CHEBI:194288) is a triazoles (CHEBI:35727)
IUPAC Name 
3-methyl-4-(4-phenylmethoxyphenyl)-5-prop-2-enylsulanyl-1,2,4-triazole
Manual XrefsDatabases
2028602ChemSpider