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CHEBI:42614 - 4-(5-PYRIDIN-4-YL-1H-1,2,4-TRIAZOL-3-YL)PYRIDINE-2-CARBONITRILE

Default Structure
ChEBI IDCHEBI:42614
ChEBI Name4-(5-PYRIDIN-4-YL-1H-1,2,4-TRIAZOL-3-YL)PYRIDINE-2-CARBONITRILE
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC13H8N6
Net Charge0
Average Mass248.249
Monoisotopic Mass248.08104
SMILESN#Cc1cc(-c2nnc(-c3ccncc3)n2)ccn1
InChIInChI=1S/C13H8N6/c14-8-11-7-10(3-6-16-11)13-17-12(18-19-13)9-1-4-15-5-2-9/h1-7H,(H,17,18,19)
InChIKeyUBVZQGOVTLIHLH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(5-PYRIDIN-4-YL-1H-1,2,4-TRIAZOL-3-YL)PYRIDINE-2-CARBONITRILE (CHEBI:42614) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
4-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carbonitrilePDBeChem
4-(5-PYRIDIN-4-YL-1H-1,2,4-TRIAZOL-3-YL)PYRIDINE-2-CARBONITRILEPDBeChem
FYX-051DrugCentral
topiloricDrugCentral
uriadecDrugCentral
Manual XrefsDatabases
4888DrugCentral
FYXPDBeChem
Registry NumbersSources
CAS:577778-58-6DrugCentral