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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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