N-[4-(4-cyanophenyl)phenyl]-6,6-dimethyl-3-methylsulfonyl-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carboxamide

Systemtic Name: N-[4-(4-cyanophenyl)phenyl]-6,6-dimethyl-3-methylsulfonyl-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carboxamide Openeye Name: N-[4-(4-cyanophenyl)phenyl]-6,6-dimethyl-3-methylsulfonyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxamide CAS Name: N-[4-(4-cyanophenyl)phenyl]-6,6-dimethyl-3-methylsulfonyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxamide IUPAC Name: N-[4-(4-cyanophenyl)phenyl]-6,6-dimethyl-3-methylsulfonyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxamide Traditional Name: N-[4-(4-cyanophenyl)phenyl]-4-keto-3-mesyl-6,6-dimethyl-5,7-dihydroisobenzothiophene-1-carboxamide Formula: C25H22N2O4S2 MolecularWeight: 478.58318

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)S(=O)(=O)C)C(=O)NC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)S(=O)(=O)C)C(=O)NC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)C

InChI

InChI=1S/C25H22N2O4S2/c1-25(2)12-19-21(20(28)13-25)24(33(3,30)31)32-22(19)23(29)27-18-10-8-17(9-11-18)16-6-4-15(14-26)5-7-16/h4-11H,12-13H2,1-3H3,(H,27,29)