CHEBI:116807 - 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-3-methylbutanoic acid

ChEBI IDCHEBI:116807
ChEBI Name2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-3-methylbutanoic acid
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FormulaC23H20N2O2S
Net Charge0
Average Mass388.492
Monoisotopic Mass388.12455
SMILESCC(C)C(Sc1nc(-c2ccccc2)cc(-c2ccccc2)c1C#N)C(=O)O
InChIInChI=1S/C23H20N2O2S/c1-15(2)21(23(26)27)28-22-19(14-24)18(16-9-5-3-6-10-16)13-20(25-22)17-11-7-4-8-12-17/h3-13,15,21H,1-2H3,(H,26,27)
InChIKeySFXNLOPHCQYBNS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-3-methylbutanoic acid (CHEBI:116807) is a phenylpyridine (CHEBI:38193)
Manual XrefsDatabases
LSM-28259LINCS