2-oxidanyl-6-[1-(phenylmethyl)cyclopentyl]-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 2-oxidanyl-6-[1-(phenylmethyl)cyclopentyl]-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 6-(1-benzylcyclopentyl)-2-hydroxy-3-(2-isopropylphenyl)sulfanyl-pyran-4-one CAS Name: 2-hydroxy-6-[1-(phenylmethyl)cyclopentyl]-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 6-(1-benzylcyclopentyl)-2-hydroxy-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 6-(1-benzylcyclopentyl)-2-hydroxy-3-(o-cumenylthio)pyran-4-one Formula: C26H28O3S MolecularWeight: 420.56372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3(CCCC3)CC4=CC=CC=C4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3(CCCC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C26H28O3S/c1-18(2)20-12-6-7-13-22(20)30-24-21(27)16-23(29-25(24)28)26(14-8-9-15-26)17-19-10-4-3-5-11-19/h3-7,10-13,16,18,28H,8-9,14-15,17H2,1-2H3