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

Systemtic Name: 3,5-dinitro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dinitro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dinitro-N-[[4-(phenethylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dinitro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dinitro-N-[[4-(phenethylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C22H19N5O7S2 MolecularWeight: 529.54556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O7S2/c28-21(16-12-18(26(29)30)14-19(13-16)27(31)32)25-22(35)24-17-6-8-20(9-7-17)36(33,34)23-11-10-15-4-2-1-3-5-15/h1-9,12-14,23H,10-11H2,(H2,24,25,28,35)