3-[[2-(4-fluorophenyl)-4-(4-fluorophenyl)sulfanyl-6-propan-2-yl-phenoxy]methyl]oxan-2-one

Systemtic Name: 3-[[2-(4-fluorophenyl)-4-(4-fluorophenyl)sulfanyl-6-propan-2-yl-phenoxy]methyl]oxan-2-one Openeye Name: 3-[[2-(4-fluorophenyl)-4-(4-fluorophenyl)sulfanyl-6-isopropyl-phenoxy]methyl]tetrahydropyran-2-one CAS Name: 3-[[2-(4-fluorophenyl)-4-[(4-fluorophenyl)thio]-6-propan-2-ylphenoxy]methyl]-2-oxanone IUPAC Name: 3-[[2-(4-fluorophenyl)-4-(4-fluorophenyl)sulfanyl-6-propan-2-ylphenoxy]methyl]oxan-2-one Traditional Name: 3-[[2-(4-fluorophenyl)-4-[(4-fluorophenyl)thio]-6-isopropyl-phenoxy]methyl]tetrahydropyran-2-one Formula: C27H26F2O3S MolecularWeight: 468.555346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC(=C1)SC2=CC=C(C=C2)F)C3=CC=C(C=C3)F)OCC4CCCOC4=O

Isomeric SMILES

CC(C)C1=C(C(=CC(=C1)SC2=CC=C(C=C2)F)C3=CC=C(C=C3)F)OCC4CCCOC4=O

InChI

InChI=1S/C27H26F2O3S/c1-17(2)24-14-23(33-22-11-9-21(29)10-12-22)15-25(18-5-7-20(28)8-6-18)26(24)32-16-19-4-3-13-31-27(19)30/h5-12,14-15,17,19H,3-4,13,16H2,1-2H3