4,4-dimethyl-3-(4-methylsulfonylphenyl)-2-phenyl-thieno[2,3-c]furan-6-one

Systemtic Name: 4,4-dimethyl-3-(4-methylsulfonylphenyl)-2-phenyl-thieno[2,3-c]furan-6-one Openeye Name: 4,4-dimethyl-3-(4-methylsulfonylphenyl)-2-phenyl-thieno[2,3-c]furan-6-one CAS Name: 4,4-dimethyl-3-(4-methylsulfonylphenyl)-2-phenyl-6-thieno[2,3-c]furanone IUPAC Name: 4,4-dimethyl-3-(4-methylsulfonylphenyl)-2-phenylthieno[2,3-c]furan-6-one Traditional Name: 3-(4-mesylphenyl)-4,4-dimethyl-2-phenyl-thieno[2,3-c]furan-6-one Formula: C21H18O4S2 MolecularWeight: 398.49522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=O)O1)SC(=C2C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1(C2=C(C(=O)O1)SC(=C2C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4)C

InChI

InChI=1S/C21H18O4S2/c1-21(2)17-16(13-9-11-15(12-10-13)27(3,23)24)18(14-7-5-4-6-8-14)26-19(17)20(22)25-21/h4-12H,1-3H3