2-hexyl-6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-3H-pyran-4-one

Systemtic Name: 2-hexyl-6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-3H-pyran-4-one Openeye Name: 5-benzylsulfanyl-2-hexyl-6-hydroxy-2-phenyl-3H-pyran-4-one CAS Name: 2-hexyl-6-hydroxy-2-phenyl-5-(phenylmethylthio)-3H-pyran-4-one IUPAC Name: 5-benzylsulfanyl-2-hexyl-6-hydroxy-2-phenyl-3H-pyran-4-one Traditional Name: 5-(benzylthio)-2-hexyl-6-hydroxy-2-phenyl-3H-pyran-4-one Formula: C24H28O3S MolecularWeight: 396.54232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H28O3S/c1-2-3-4-11-16-24(20-14-9-6-10-15-20)17-21(25)22(23(26)27-24)28-18-19-12-7-5-8-13-19/h5-10,12-15,26H,2-4,11,16-18H2,1H3