2-(4-nitrophenoxy)-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-nitrophenoxy)-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-nitrophenoxy)-N-[[(4-phenylbenzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-nitrophenoxy)-N-[[[oxo-(4-phenylphenyl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-nitrophenoxy)-N-[[(4-phenylbenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-nitrophenoxy)-N-[[(4-phenylbenzoyl)amino]thiocarbamoyl]acetamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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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)COC3=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)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O5S/c27-20(14-31-19-12-10-18(11-13-19)26(29)30)23-22(32)25-24-21(28)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-13H,14H2,(H,24,28)(H2,23,25,27,32)