(E)-3-(5-phenylfuran-2-yl)-N-[[3-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(5-phenylfuran-2-yl)-N-[[3-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(5-phenyl-2-furyl)-N-[[3-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-3-(5-phenylfuran-2-yl)-N-[[3-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(5-phenyl-2-furyl)-N-[(3-propionamidophenyl)thiocarbamoyl]acrylamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C23H21N3O3S/c1-2-21(27)24-17-9-6-10-18(15-17)25-23(30)26-22(28)14-12-19-11-13-20(29-19)16-7-4-3-5-8-16/h3-15H,2H2,1H3,(H,24,27)(H2,25,26,28,30)/b14-12+