(E)-3-(3-nitrophenyl)-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-[[(4-phenylbenzoyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[[[oxo-(4-phenylphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-[[(4-phenylbenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-[[(4-phenylbenzoyl)amino]thiocarbamoyl]acrylamide Formula: C23H18N4O4S MolecularWeight: 446.47842

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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)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H18N4O4S/c28-21(14-9-16-5-4-8-20(15-16)27(30)31)24-23(32)26-25-22(29)19-12-10-18(11-13-19)17-6-2-1-3-7-17/h1-15H,(H,25,29)(H2,24,26,28,32)/b14-9+