4-[2,5-dimethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoyl]pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[2,5-dimethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoyl]pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[2,5-dimethyl-3-[2-[4-(2-thienylmethyl)piperazin-1-yl]acetyl]pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[2,5-dimethyl-3-[1-oxo-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]ethyl]-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[2,5-dimethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetyl]pyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[2,5-dimethyl-3-[2-[4-(2-thenyl)piperazino]acetyl]pyrrol-1-yl]benzenesulfonamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C23H28N4O3S2/c1-17-14-22(18(2)27(17)19-5-7-21(8-6-19)32(24,29)30)23(28)16-26-11-9-25(10-12-26)15-20-4-3-13-31-20/h3-8,13-14H,9-12,15-16H2,1-2H3,(H2,24,29,30)