N-ethyl-4-methyl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-ethyl-4-methyl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-ethyl-4-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-ethyl-4-methyl-3-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-ethyl-4-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-ethyl-4-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5S/c1-3-21-30(28,29)18-9-4-15(2)19(14-18)20(25)23-12-10-22(11-13-23)16-5-7-17(8-6-16)24(26)27/h4-9,14,21H,3,10-13H2,1-2H3