3-nitro-4-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-(3-sulfamoylanilino)ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-(3-sulfamoylanilino)ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-(3-sulfamoylanilino)ethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-(3-sulfamoylanilino)ethyl]thio]-3-nitro-benzamide Formula: C15H14N4O6S2 MolecularWeight: 410.42486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O6S2/c16-15(21)9-4-5-13(12(6-9)19(22)23)26-8-14(20)18-10-2-1-3-11(7-10)27(17,24)25/h1-7H,8H2,(H2,16,21)(H,18,20)(H2,17,24,25)