2-nitro-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-nitro-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-nitro-N-[[(4-phenylbenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-nitro-N-[[[oxo-(4-phenylphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-nitro-N-[[(4-phenylbenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2-nitro-N-[[(4-phenylbenzoyl)amino]thiocarbamoyl]benzamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N4O4S/c26-19(16-12-10-15(11-13-16)14-6-2-1-3-7-14)23-24-21(30)22-20(27)17-8-4-5-9-18(17)25(28)29/h1-13H,(H,23,26)(H2,22,24,27,30)