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CHEBI:94286 - 3,5-bis[[2-(4-fluorophenyl)-2-oxoethyl]thio]-4-isothiazolecarbonitrile

ChEBI IDCHEBI:94286
ChEBI Name3,5-bis[[2-(4-fluorophenyl)-2-oxoethyl]thio]-4-isothiazolecarbonitrile
Stars
DownloadsMolfile
FormulaC20H12F2N2O2S3
Net Charge0
Average Mass446.525
Monoisotopic Mass446.00290
SMILESN#Cc1c(SCC(=O)c2ccc(F)cc2)nsc1SCC(=O)c1ccc(F)cc1
InChIInChI=1S/C20H12F2N2O2S3/c21-14-5-1-12(2-6-14)17(25)10-27-19-16(9-23)20(29-24-19)28-11-18(26)13-3-7-15(22)8-4-13/h1-8H,10-11H2
InChIKeyIECBSRBZPZTUKJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,5-bis[[2-(4-fluorophenyl)-2-oxoethyl]thio]-4-isothiazolecarbonitrile (CHEBI:94286) is a aromatic ketone (CHEBI:76224)
Manual XrefsDatabases
LSM-4913LINCS