3,5-dinitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide

Systemtic Name: 3,5-dinitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide Openeye Name: 3,5-dinitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide CAS Name: N-[[[anilino(oxo)methyl]hydrazo]-sulfanylidenemethyl]-3,5-dinitrobenzamide IUPAC Name: 3,5-dinitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide Traditional Name: 3,5-dinitro-N-[(phenylcarbamoylamino)thiocarbamoyl]benzamide Formula: C15H12N6O6S MolecularWeight: 404.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N6O6S/c22-13(9-6-11(20(24)25)8-12(7-9)21(26)27)17-15(28)19-18-14(23)16-10-4-2-1-3-5-10/h1-8H,(H2,16,18,23)(H2,17,19,22,28)