N-[[4-(ethanoylsulfamoyl)phenyl]carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[[4-(ethanoylsulfamoyl)phenyl]carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[4-(acetylsulfamoyl)anilino]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-nitrobenzamide Traditional Name: N-[[4-(acetylsulfamoyl)phenyl]thiocarbamoyl]-2-nitro-benzamide Formula: C16H14N4O6S2 MolecularWeight: 422.43556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O6S2/c1-10(21)19-28(25,26)12-8-6-11(7-9-12)17-16(27)18-15(22)13-4-2-3-5-14(13)20(23)24/h2-9H,1H3,(H,19,21)(H2,17,18,22,27)