EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:105618 - 3-(4-methylphenyl)-6-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

ChEBI IDCHEBI:105618
ChEBI Name3-(4-methylphenyl)-6-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Stars
Last Modified1 June 2018
DownloadsMolfile
FormulaC15H11N5S
Net Charge0
Average Mass293.355
Monoisotopic Mass293.07352
SMILESCc1ccc(-c2nnc3sc(-c4ccncc4)nn23)cc1
InChIInChI=1S/C15H11N5S/c1-10-2-4-11(5-3-10)13-17-18-15-20(13)19-14(21-15)12-6-8-16-9-7-12/h2-9H,1H3
InChIKeyKIEHGMVRXGSIJJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(4-methylphenyl)-6-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CHEBI:105618) is a triazolothiadiazole (CHEBI:140920)
Manual XrefsDatabases
LSM-16981LINCS