3,5-dinitro-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,5-dinitro-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dinitro-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dinitro-N-[[4-(propylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dinitro-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dinitro-N-[[4-(propylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C17H17N5O7S2 MolecularWeight: 467.47618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O7S2/c1-2-7-18-31(28,29)15-5-3-12(4-6-15)19-17(30)20-16(23)11-8-13(21(24)25)10-14(9-11)22(26)27/h3-6,8-10,18H,2,7H2,1H3,(H2,19,20,23,30)