N-(2-methoxy-5-nitro-phenyl)-4-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-4-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-4-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide CAS Name: N-(2-methoxy-5-nitrophenyl)-4-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-4-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-4-(nicotinamidocarbamoyl)benzenesulfonamide Formula: C20H17N5O7S MolecularWeight: 471.44328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H17N5O7S/c1-32-18-9-6-15(25(28)29)11-17(18)24-33(30,31)16-7-4-13(5-8-16)19(26)22-23-20(27)14-3-2-10-21-12-14/h2-12,24H,1H3,(H,22,26)(H,23,27)