CHEBI:188742 - 3-Phenyl-4-(phenylethynyl)-1H-pyrazol-5-amine

ChEBI IDCHEBI:188742
ChEBI Name3-Phenyl-4-(phenylethynyl)-1H-pyrazol-5-amine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H13N3
Net Charge0
Average Mass259.312
Monoisotopic Mass259.11095
SMILESNc1nnc(-c2ccccc2)c1C#Cc1ccccc1
InChIInChI=1S/C17H13N3/c18-17-15(12-11-13-7-3-1-4-8-13)16(19-20-17)14-9-5-2-6-10-14/h1-10H,(H3,18,19,20)
InChIKeyRYLCVHNCXAIORH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
3-Phenyl-4-(phenylethynyl)-1H-pyrazol-5-amine (CHEBI:188742) is a pyrazoles (CHEBI:26410)
3-Phenyl-4-(phenylethynyl)-1H-pyrazol-5-amine (CHEBI:188742) is a ring assembly (CHEBI:36820)
IUPAC Name 
5-phenyl-4-(2-phenylethynyl)-1H-pyrazol-3-amine
Manual XrefsDatabases
65323901ChemSpider