2-oxidanyl-6-(1-phenethylcyclopentyl)-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 2-oxidanyl-6-(1-phenethylcyclopentyl)-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 2-hydroxy-3-(2-isopropylphenyl)sulfanyl-6-(1-phenethylcyclopentyl)pyran-4-one CAS Name: 2-hydroxy-6-(1-phenethylcyclopentyl)-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-(1-phenethylcyclopentyl)-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 2-hydroxy-3-(o-cumenylthio)-6-(1-phenethylcyclopentyl)pyran-4-one Formula: C27H30O3S MolecularWeight: 434.5903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3(CCCC3)CCC4=CC=CC=C4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3(CCCC3)CCC4=CC=CC=C4)O

InChI

InChI=1S/C27H30O3S/c1-19(2)21-12-6-7-13-23(21)31-25-22(28)18-24(30-26(25)29)27(15-8-9-16-27)17-14-20-10-4-3-5-11-20/h3-7,10-13,18-19,29H,8-9,14-17H2,1-2H3