2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-6-[3-(trifluoromethyl)phenyl]pyran-4-one

Systemtic Name: 2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-6-[3-(trifluoromethyl)phenyl]pyran-4-one Openeye Name: 2-hydroxy-3-(2-isopropylphenyl)sulfanyl-6-[3-(trifluoromethyl)phenyl]pyran-4-one CAS Name: 2-hydroxy-3-[(2-propan-2-ylphenyl)thio]-6-[3-(trifluoromethyl)phenyl]-4-pyranone IUPAC Name: 2-hydroxy-3-(2-propan-2-ylphenyl)sulfanyl-6-[3-(trifluoromethyl)phenyl]pyran-4-one Traditional Name: 2-hydroxy-3-(o-cumenylthio)-6-[3-(trifluoromethyl)phenyl]pyran-4-one Formula: C21H17F3O3S MolecularWeight: 406.41809

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17F3O3S/c1-12(2)15-8-3-4-9-18(15)28-19-16(25)11-17(27-20(19)26)13-6-5-7-14(10-13)21(22,23)24/h3-12,26H,1-2H3