2-(4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-5,6-dihydro-4H-1-benzothiophen-7-one

Systemtic Name: 2-(4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-5,6-dihydro-4H-1-benzothiophen-7-one Openeye Name: 2-(4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-5,6-dihydro-4H-benzothiophen-7-one CAS Name: 2-(4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-5,6-dihydro-4H-1-benzothiophen-7-one IUPAC Name: 2-(4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-5,6-dihydro-4H-1-benzothiophen-7-one Traditional Name: 3-(4-mesylphenyl)-2-(4-methoxyphenyl)-5,6-dihydro-4H-benzothiophen-7-one Formula: C22H20O4S2 MolecularWeight: 412.5218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=C(S2)C(=O)CCC3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=C(S2)C(=O)CCC3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C22H20O4S2/c1-26-16-10-6-15(7-11-16)21-20(18-4-3-5-19(23)22(18)27-21)14-8-12-17(13-9-14)28(2,24)25/h6-13H,3-5H2,1-2H3