N-methyl-3-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-methyl-3-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-methyl-3-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-methyl-3-[[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-methyl-3-[4-(4-methylsulfonyl-2-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 3-[4-(4-mesyl-2-nitro-phenyl)piperazine-1-carbonyl]-N-methyl-benzenesulfonamide Formula: C19H22N4O7S2 MolecularWeight: 482.53058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O7S2/c1-20-32(29,30)16-5-3-4-14(12-16)19(24)22-10-8-21(9-11-22)17-7-6-15(31(2,27)28)13-18(17)23(25)26/h3-7,12-13,20H,8-11H2,1-2H3