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

Systemtic Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-[2-(2-thienyl)acetyl]piperazin-1-yl]benzenesulfonamide CAS Name: 4-methoxy-N-methyl-3-[4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-N-phenethylbenzenesulfonamide IUPAC Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]benzenesulfonamide Traditional Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-[2-(2-thienyl)acetyl]piperazino]benzenesulfonamide Formula: C26H31N3O4S2 MolecularWeight: 513.67204

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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)CC4=CC=CS4

Isomeric SMILES

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C26H31N3O4S2/c1-27(13-12-21-7-4-3-5-8-21)35(31,32)23-10-11-25(33-2)24(20-23)28-14-16-29(17-15-28)26(30)19-22-9-6-18-34-22/h3-11,18,20H,12-17,19H2,1-2H3