(E)-3-phenyl-N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-phenyl-N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-N-[[3-[(1-oxo-2-phenylethyl)amino]anilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-3-phenyl-N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-phenyl-N-[[3-[(2-phenylacetyl)amino]phenyl]thiocarbamoyl]acrylamide Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H21N3O2S/c28-22(15-14-18-8-3-1-4-9-18)27-24(30)26-21-13-7-12-20(17-21)25-23(29)16-19-10-5-2-6-11-19/h1-15,17H,16H2,(H,25,29)(H2,26,27,28,30)/b15-14+