3-(1-benzothiophen-5-yloxy)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one

Systemtic Name: 3-(1-benzothiophen-5-yloxy)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Openeye Name: 3-(benzothiophen-5-yloxy)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one CAS Name: 3-(1-benzothiophen-5-yloxy)-5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-furanone IUPAC Name: 3-(1-benzothiophen-5-yloxy)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Traditional Name: 3-(benzothiophen-5-yloxy)-4-(4-mesylphenyl)-5,5-dimethyl-furan-2-one Formula: C21H18O5S2 MolecularWeight: 414.49462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)OC2=CC3=C(C=C2)SC=C3)C4=CC=C(C=C4)S(=O)(=O)C)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)OC2=CC3=C(C=C2)SC=C3)C4=CC=C(C=C4)S(=O)(=O)C)C

InChI

InChI=1S/C21H18O5S2/c1-21(2)18(13-4-7-16(8-5-13)28(3,23)24)19(20(22)26-21)25-15-6-9-17-14(12-15)10-11-27-17/h4-12H,1-3H3