4-azanyl-N-[3-(4-azanyl-3-nitro-phenyl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-benzenesulfonamide

Systemtic Name: 4-azanyl-N-[3-(4-azanyl-3-nitro-phenyl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-benzenesulfonamide Openeye Name: 4-amino-N-[1-[(4-amino-3-nitro-phenyl)methyl]-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-3,5-dimethyl-benzenesulfonamide CAS Name: 4-amino-N-[3-(4-amino-3-nitrophenyl)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]-3,5-dimethylbenzenesulfonamide IUPAC Name: 4-amino-N-[3-(4-amino-3-nitrophenyl)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]-3,5-dimethylbenzenesulfonamide Traditional Name: 4-amino-N-[1-(4-amino-3-nitro-benzyl)-2-keto-2-(4-methylpiperidino)ethyl]-3,5-dimethyl-benzenesulfonamide Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CC2=CC(=C(C=C2)N)[N+](=O)[O-])NS(=O)(=O)C3=CC(=C(C(=C3)C)N)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CC2=CC(=C(C=C2)N)[N+](=O)[O-])NS(=O)(=O)C3=CC(=C(C(=C3)C)N)C

InChI

InChI=1S/C23H31N5O5S/c1-14-6-8-27(9-7-14)23(29)20(12-17-4-5-19(24)21(13-17)28(30)31)26-34(32,33)18-10-15(2)22(25)16(3)11-18/h4-5,10-11,13-14,20,26H,6-9,12,24-25H2,1-3H3