3-nitro-N-[3-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]butan-2-yl]sulfanylphenyl]benzamide

Systemtic Name: 3-nitro-N-[3-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]butan-2-yl]sulfanylphenyl]benzamide Openeye Name: 3-nitro-N-[3-[1-[(4-sulfamoylphenyl)carbamoyl]propylsulfanyl]phenyl]benzamide CAS Name: 3-nitro-N-[3-[[1-oxo-1-(4-sulfamoylanilino)butan-2-yl]thio]phenyl]benzamide IUPAC Name: 3-nitro-N-[3-[1-oxo-1-(4-sulfamoylanilino)butan-2-yl]sulfanylphenyl]benzamide Traditional Name: 3-nitro-N-[3-[1-[(4-sulfamoylphenyl)carbamoyl]propylthio]phenyl]benzamide Formula: C23H22N4O6S2 MolecularWeight: 514.57398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O6S2/c1-2-21(23(29)25-16-9-11-20(12-10-16)35(24,32)33)34-19-8-4-6-17(14-19)26-22(28)15-5-3-7-18(13-15)27(30)31/h3-14,21H,2H2,1H3,(H,25,29)(H,26,28)(H2,24,32,33)