EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:108302 - 4-(phenylmethyl)-3-(5-propyl-3-thiophenyl)-1H-1,2,4-triazole-5-thione

ChEBI IDCHEBI:108302
ChEBI Name4-(phenylmethyl)-3-(5-propyl-3-thiophenyl)-1H-1,2,4-triazole-5-thione
Stars
DownloadsMolfile
FormulaC16H17N3S2
Net Charge0
Average Mass315.467
Monoisotopic Mass315.08639
SMILESCCCc1cc(-c2nnc(=S)n2Cc2ccccc2)cs1
InChIInChI=1S/C16H17N3S2/c1-2-6-14-9-13(11-21-14)15-17-18-16(20)19(15)10-12-7-4-3-5-8-12/h3-5,7-9,11H,2,6,10H2,1H3,(H,18,20)
InChIKeyMEAZJYZPOWUZGB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(phenylmethyl)-3-(5-propyl-3-thiophenyl)-1H-1,2,4-triazole-5-thione (CHEBI:108302) is a benzenes (CHEBI:22712)
Manual XrefsDatabases
LSM-19679LINCS