(E)-3-(4-nitrophenyl)-N-[[3-(2-phenoxyethanoylamino)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-nitrophenyl)-N-[[3-(2-phenoxyethanoylamino)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-nitrophenyl)-N-[[3-[(2-phenoxyacetyl)amino]phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-nitrophenyl)-N-[[3-[(1-oxo-2-phenoxyethyl)amino]anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-nitrophenyl)-N-[[3-[(2-phenoxyacetyl)amino]phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-nitrophenyl)-N-[[3-[(2-phenoxyacetyl)amino]phenyl]thiocarbamoyl]acrylamide Formula: C24H20N4O5S MolecularWeight: 476.5044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O5S/c29-22(14-11-17-9-12-20(13-10-17)28(31)32)27-24(34)26-19-6-4-5-18(15-19)25-23(30)16-33-21-7-2-1-3-8-21/h1-15H,16H2,(H,25,30)(H2,26,27,29,34)/b14-11+