6-(4-methylsulfanylphenyl)-3-(4-methylsulfonylphenyl)-4-phenyl-pyran-2-one

Systemtic Name: 6-(4-methylsulfanylphenyl)-3-(4-methylsulfonylphenyl)-4-phenyl-pyran-2-one Openeye Name: 6-(4-methylsulfanylphenyl)-3-(4-methylsulfonylphenyl)-4-phenyl-pyran-2-one CAS Name: 3-(4-methylsulfonylphenyl)-6-[4-(methylthio)phenyl]-4-phenyl-2-pyranone IUPAC Name: 6-(4-methylsulfanylphenyl)-3-(4-methylsulfonylphenyl)-4-phenylpyran-2-one Traditional Name: 3-(4-mesylphenyl)-6-[4-(methylthio)phenyl]-4-phenyl-pyran-2-one Formula: C25H20O4S2 MolecularWeight: 448.5539

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC(=C(C(=O)O2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC(=C(C(=O)O2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H20O4S2/c1-30-20-12-8-18(9-13-20)23-16-22(17-6-4-3-5-7-17)24(25(26)29-23)19-10-14-21(15-11-19)31(2,27)28/h3-16H,1-2H3