1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone

Systemtic Name: 1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone Openeye Name: 1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone CAS Name: 1-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-2-[4-(1-pyrrolyl)phenyl]ethanone IUPAC Name: 1-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-2-(4-pyrrol-1-ylphenyl)ethanone Traditional Name: 1-[4-(4-mesyl-2-nitro-phenyl)piperazino]-2-(4-pyrrol-1-ylphenyl)ethanone Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)N4C=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)N4C=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O5S/c1-33(31,32)20-8-9-21(22(17-20)27(29)30)25-12-14-26(15-13-25)23(28)16-18-4-6-19(7-5-18)24-10-2-3-11-24/h2-11,17H,12-16H2,1H3