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

Systemtic Name: 2-butyl-6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-3H-pyran-4-one Openeye Name: 5-benzylsulfanyl-2-butyl-6-hydroxy-2-phenyl-3H-pyran-4-one CAS Name: 2-butyl-6-hydroxy-2-phenyl-5-(phenylmethylthio)-3H-pyran-4-one IUPAC Name: 5-benzylsulfanyl-2-butyl-6-hydroxy-2-phenyl-3H-pyran-4-one Traditional Name: 5-(benzylthio)-2-butyl-6-hydroxy-2-phenyl-3H-pyran-4-one Formula: C22H24O3S MolecularWeight: 368.48916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24O3S/c1-2-3-14-22(18-12-8-5-9-13-18)15-19(23)20(21(24)25-22)26-16-17-10-6-4-7-11-17/h4-13,24H,2-3,14-16H2,1H3