N-(3-nitrophenyl)-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]methanesulfonamide

Systemtic Name: N-(3-nitrophenyl)-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]methanesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-N-(3-nitrophenyl)methanesulfonamide CAS Name: N-(3-nitrophenyl)-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]methanesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(3-nitrophenyl)methanesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-keto-ethyl]-N-(3-nitrophenyl)methanesulfonamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5S/c1-30(28,29)23(18-8-5-9-19(14-18)24(26)27)16-20(25)22-12-10-21(11-13-22)15-17-6-3-2-4-7-17/h2-9,14H,10-13,15-16H2,1H3