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

Systemtic Name: 5,5-diethyl-4-(4-methylsulfonylphenyl)-3-phenylsulfanyl-furan-2-one Openeye Name: 5,5-diethyl-4-(4-methylsulfonylphenyl)-3-phenylsulfanyl-furan-2-one CAS Name: 5,5-diethyl-4-(4-methylsulfonylphenyl)-3-(phenylthio)-2-furanone IUPAC Name: 5,5-diethyl-4-(4-methylsulfonylphenyl)-3-phenylsulfanylfuran-2-one Traditional Name: 5,5-diethyl-4-(4-mesylphenyl)-3-(phenylthio)furan-2-one Formula: C21H22O4S2 MolecularWeight: 402.52698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C(=O)O1)SC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)CC

Isomeric SMILES

CCC1(C(=C(C(=O)O1)SC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)CC

InChI

InChI=1S/C21H22O4S2/c1-4-21(5-2)18(15-11-13-17(14-12-15)27(3,23)24)19(20(22)25-21)26-16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3