N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-N-(3-nitrophenyl)methanesulfonamide

Systemtic Name: N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-N-(3-nitrophenyl)methanesulfonamide Openeye Name: N-(3-nitrophenyl)-N-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]methanesulfonamide CAS Name: N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-N-(3-nitrophenyl)methanesulfonamide IUPAC Name: N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-N-(3-nitrophenyl)methanesulfonamide Traditional Name: N-[2-keto-2-(4-tosylpiperazino)ethyl]-N-(3-nitrophenyl)methanesulfonamide Formula: C20H24N4O7S2 MolecularWeight: 496.55716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C20H24N4O7S2/c1-16-6-8-19(9-7-16)33(30,31)22-12-10-21(11-13-22)20(25)15-23(32(2,28)29)17-4-3-5-18(14-17)24(26)27/h3-9,14H,10-13,15H2,1-2H3