2-(4-tert-butylphenyl)-6-oxidanyl-5-(phenylmethylsulfanyl)-2,3-dihydropyran-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6-oxidanyl-5-(phenylmethylsulfanyl)-2,3-dihydropyran-4-one Openeye Name: 5-benzylsulfanyl-2-(4-tert-butylphenyl)-6-hydroxy-2,3-dihydropyran-4-one CAS Name: 2-(4-tert-butylphenyl)-6-hydroxy-5-(phenylmethylthio)-2,3-dihydropyran-4-one IUPAC Name: 5-benzylsulfanyl-2-(4-tert-butylphenyl)-6-hydroxy-2,3-dihydropyran-4-one Traditional Name: 5-(benzylthio)-2-(4-tert-butylphenyl)-6-hydroxy-2,3-dihydropyran-4-one Formula: C22H24O3S MolecularWeight: 368.48916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2CC(=O)C(=C(O2)O)SCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2CC(=O)C(=C(O2)O)SCC3=CC=CC=C3

InChI

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