6-[4-(cyclohexylmethoxy)phenyl]-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 6-[4-(cyclohexylmethoxy)phenyl]-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 6-[4-(cyclohexylmethoxy)phenyl]-2-hydroxy-3-(2-isopropylphenyl)sulfanyl-pyran-4-one CAS Name: 6-[4-(cyclohexylmethoxy)phenyl]-2-hydroxy-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 6-[4-(cyclohexylmethoxy)phenyl]-2-hydroxy-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 6-[4-(cyclohexylmethoxy)phenyl]-2-hydroxy-3-(o-cumenylthio)pyran-4-one Formula: C27H30O4S MolecularWeight: 450.5897

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCC4CCCCC4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCC4CCCCC4)O

InChI

InChI=1S/C27H30O4S/c1-18(2)22-10-6-7-11-25(22)32-26-23(28)16-24(31-27(26)29)20-12-14-21(15-13-20)30-17-19-8-4-3-5-9-19/h6-7,10-16,18-19,29H,3-5,8-9,17H2,1-2H3