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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24O3S/c1-16(2)13-22(18-11-7-4-8-12-18)14-19(23)20(21(24)25-22)26-15-17-9-5-3-6-10-17/h3-12,16,24H,13-15H2,1-2H3