6-(2-methyl-4-phenyl-butan-2-yl)-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 6-(2-methyl-4-phenyl-butan-2-yl)-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 6-(1,1-dimethyl-3-phenyl-propyl)-2-hydroxy-3-(2-isopropylphenyl)sulfanyl-pyran-4-one CAS Name: 2-hydroxy-6-(2-methyl-4-phenylbutan-2-yl)-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-(2-methyl-4-phenylbutan-2-yl)-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 6-(1,1-dimethyl-3-phenyl-propyl)-2-hydroxy-3-(o-cumenylthio)pyran-4-one Formula: C25H28O3S MolecularWeight: 408.55302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C(C)(C)CCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C(C)(C)CCC3=CC=CC=C3)O

InChI

InChI=1S/C25H28O3S/c1-17(2)19-12-8-9-13-21(19)29-23-20(26)16-22(28-24(23)27)25(3,4)15-14-18-10-6-5-7-11-18/h5-13,16-17,27H,14-15H2,1-4H3