N-[[3-(methylcarbamoyl)phenyl]carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[[3-(methylcarbamoyl)phenyl]carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[3-(methylcarbamoyl)phenyl]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[3-(methylcarbamoyl)anilino]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[[3-(methylcarbamoyl)phenyl]carbamothioyl]-2-nitrobenzamide Traditional Name: N-[[3-(methylcarbamoyl)phenyl]thiocarbamoyl]-2-nitro-benzamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O4S/c1-17-14(21)10-5-4-6-11(9-10)18-16(25)19-15(22)12-7-2-3-8-13(12)20(23)24/h2-9H,1H3,(H,17,21)(H2,18,19,22,25)