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

Systemtic Name: 6-[1-(4-methylpentyl)cyclopropyl]-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 2-hydroxy-6-(1-isohexylcyclopropyl)-3-(2-isopropylphenyl)sulfanyl-pyran-4-one CAS Name: 2-hydroxy-6-[1-(4-methylpentyl)cyclopropyl]-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-[1-(4-methylpentyl)cyclopropyl]-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 2-hydroxy-6-(1-isohexylcyclopropyl)-3-(o-cumenylthio)pyran-4-one Formula: C23H30O3S MolecularWeight: 386.5475

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1(CC1)C2=CC(=O)C(=C(O2)O)SC3=CC=CC=C3C(C)C

Isomeric SMILES

CC(C)CCCC1(CC1)C2=CC(=O)C(=C(O2)O)SC3=CC=CC=C3C(C)C

InChI

InChI=1S/C23H30O3S/c1-15(2)8-7-11-23(12-13-23)20-14-18(24)21(22(25)26-20)27-19-10-6-5-9-17(19)16(3)4/h5-6,9-10,14-16,25H,7-8,11-13H2,1-4H3