4-[[3,5-dinitro-6-[(4-sulfamoylphenyl)amino]pyridin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[3,5-dinitro-6-[(4-sulfamoylphenyl)amino]pyridin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[3,5-dinitro-6-(4-sulfamoylanilino)-2-pyridyl]amino]benzenesulfonamide CAS Name: 4-[[3,5-dinitro-6-(4-sulfamoylanilino)-2-pyridinyl]amino]benzenesulfonamide IUPAC Name: 4-[[3,5-dinitro-6-(4-sulfamoylanilino)pyridin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[3,5-dinitro-6-(4-sulfamoylanilino)-2-pyridyl]amino]benzenesulfonamide Formula: C17H15N7O8S2 MolecularWeight: 509.4731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=C(C(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=C(C(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C17H15N7O8S2/c18-33(29,30)12-5-1-10(2-6-12)20-16-14(23(25)26)9-15(24(27)28)17(22-16)21-11-3-7-13(8-4-11)34(19,31)32/h1-9H,(H2,18,29,30)(H2,19,31,32)(H2,20,21,22)