EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:116274 - 2-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetonitrile

ChEBI IDCHEBI:116274
ChEBI Name2-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetonitrile
Stars
DownloadsMolfile
FormulaC17H14N4OS
Net Charge0
Average Mass322.393
Monoisotopic Mass322.08883
SMILESN#CCSc1nnc(COc2ccccc2)n1-c1ccccc1
InChIInChI=1S/C17H14N4OS/c18-11-12-23-17-20-19-16(13-22-15-9-5-2-6-10-15)21(17)14-7-3-1-4-8-14/h1-10H,12-13H2
InChIKeyDPCLCSVUTDYVOW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetonitrile (CHEBI:116274) is a triazoles (CHEBI:35727)
Manual XrefsDatabases
LSM-27729LINCS