3-nitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide

Systemtic Name: 3-nitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide Openeye Name: 3-nitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide CAS Name: N-[[[anilino(oxo)methyl]hydrazo]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 3-nitro-N-[(phenylcarbamoylamino)carbamothioyl]benzamide Traditional Name: 3-nitro-N-[(phenylcarbamoylamino)thiocarbamoyl]benzamide Formula: C15H13N5O4S MolecularWeight: 359.35982

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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-]

Isomeric SMILES

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

InChI

InChI=1S/C15H13N5O4S/c21-13(10-5-4-8-12(9-10)20(23)24)17-15(25)19-18-14(22)16-11-6-2-1-3-7-11/h1-9H,(H2,16,18,22)(H2,17,19,21,25)