5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenyl-thiophen-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenyl-thiophen-2-one Openeye Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenyl-thiophen-2-one CAS Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenyl-2-thiophenone IUPAC Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenylthiophen-2-one Traditional Name: 4-(4-mesylphenyl)-5,5-dimethyl-3-phenyl-thiophen-2-one Formula: C19H18O3S2 MolecularWeight: 358.47442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)S1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1(C(=C(C(=O)S1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C19H18O3S2/c1-19(2)17(14-9-11-15(12-10-14)24(3,21)22)16(18(20)23-19)13-7-5-4-6-8-13/h4-12H,1-3H3