3-(5-methyl-2-propan-2-yl-phenyl)sulfanyl-2-oxidanyl-6-(1-phenethylcyclobutyl)pyran-4-one

Systemtic Name: 3-(5-methyl-2-propan-2-yl-phenyl)sulfanyl-2-oxidanyl-6-(1-phenethylcyclobutyl)pyran-4-one Openeye Name: 2-hydroxy-3-(2-isopropyl-5-methyl-phenyl)sulfanyl-6-(1-phenethylcyclobutyl)pyran-4-one CAS Name: 2-hydroxy-3-[(5-methyl-2-propan-2-ylphenyl)thio]-6-(1-phenethylcyclobutyl)-4-pyranone IUPAC Name: 2-hydroxy-3-(5-methyl-2-propan-2-ylphenyl)sulfanyl-6-(1-phenethylcyclobutyl)pyran-4-one Traditional Name: 2-hydroxy-3-[(2-isopropyl-5-methyl-phenyl)thio]-6-(1-phenethylcyclobutyl)pyran-4-one Formula: C27H30O3S MolecularWeight: 434.5903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)SC2=C(OC(=CC2=O)C3(CCC3)CCC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)SC2=C(OC(=CC2=O)C3(CCC3)CCC4=CC=CC=C4)O

InChI

InChI=1S/C27H30O3S/c1-18(2)21-11-10-19(3)16-23(21)31-25-22(28)17-24(30-26(25)29)27(13-7-14-27)15-12-20-8-5-4-6-9-20/h4-6,8-11,16-18,29H,7,12-15H2,1-3H3