2,5-dimethyl-2-(4-methylsulfonylphenyl)-4-phenylsulfanyl-furan-3-one

Systemtic Name: 2,5-dimethyl-2-(4-methylsulfonylphenyl)-4-phenylsulfanyl-furan-3-one Openeye Name: 2,5-dimethyl-2-(4-methylsulfonylphenyl)-4-phenylsulfanyl-furan-3-one CAS Name: 2,5-dimethyl-2-(4-methylsulfonylphenyl)-4-(phenylthio)-3-furanone IUPAC Name: 2,5-dimethyl-2-(4-methylsulfonylphenyl)-4-phenylsulfanylfuran-3-one Traditional Name: 2-(4-mesylphenyl)-2,5-dimethyl-4-(phenylthio)furan-3-one Formula: C19H18O4S2 MolecularWeight: 374.47382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(O1)(C)C2=CC=C(C=C2)S(=O)(=O)C)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)C(O1)(C)C2=CC=C(C=C2)S(=O)(=O)C)SC3=CC=CC=C3

InChI

InChI=1S/C19H18O4S2/c1-13-17(24-15-7-5-4-6-8-15)18(20)19(2,23-13)14-9-11-16(12-10-14)25(3,21)22/h4-12H,1-3H3