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

Systemtic Name: 3-[4-(1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide Openeye Name: 3-[4-(benzothiophene-2-carbonyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide CAS Name: 3-[4-[1-benzothiophen-2-yl(oxo)methyl]-1-piperazinyl]-4-methoxy-N-methyl-N-phenethylbenzenesulfonamide IUPAC Name: 3-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethylbenzenesulfonamide Traditional Name: 3-[4-(benzothiophene-2-carbonyl)piperazino]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide Formula: C29H31N3O4S2 MolecularWeight: 549.70414

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C29H31N3O4S2/c1-30(15-14-22-8-4-3-5-9-22)38(34,35)24-12-13-26(36-2)25(21-24)31-16-18-32(19-17-31)29(33)28-20-23-10-6-7-11-27(23)37-28/h3-13,20-21H,14-19H2,1-2H3