3,5-dinitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,5-dinitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dinitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dinitro-N-[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]benzamide IUPAC Name: 3,5-dinitro-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dinitro-N-[[2-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C15H9F3N4O5S MolecularWeight: 414.31597

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9F3N4O5S/c16-15(17,18)11-3-1-2-4-12(11)19-14(28)20-13(23)8-5-9(21(24)25)7-10(6-8)22(26)27/h1-7H,(H2,19,20,23,28)