3-[4-(1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]-N-[2-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide

Systemtic Name: 3-[4-(1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]-N-[2-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide Openeye Name: 3-[4-(benzothiophene-2-carbonyl)piperazin-1-yl]-N-[2-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide CAS Name: 3-[4-[1-benzothiophen-2-yl(oxo)methyl]-1-piperazinyl]-N-[2-(4-fluorophenyl)ethyl]-4-methoxybenzenesulfonamide IUPAC Name: 3-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-N-[2-(4-fluorophenyl)ethyl]-4-methoxybenzenesulfonamide Traditional Name: 3-[4-(benzothiophene-2-carbonyl)piperazino]-N-[2-(4-fluorophenyl)ethyl]-4-methoxy-benzenesulfonamide Formula: C28H28FN3O4S2 MolecularWeight: 553.668023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)F)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)F)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C28H28FN3O4S2/c1-36-25-11-10-23(38(34,35)30-13-12-20-6-8-22(29)9-7-20)19-24(25)31-14-16-32(17-15-31)28(33)27-18-21-4-2-3-5-26(21)37-27/h2-11,18-19,30H,12-17H2,1H3