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

Systemtic Name: (E)-3-(furan-2-yl)-N-[[3-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-furyl)-N-[[3-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-furanyl)-N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(furan-2-yl)-N-[[3-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-furyl)-N-[(3-propionamidophenyl)thiocarbamoyl]acrylamide Formula: C17H17N3O3S MolecularWeight: 343.40018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=CO2

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)/C=C/C2=CC=CO2

InChI

InChI=1S/C17H17N3O3S/c1-2-15(21)18-12-5-3-6-13(11-12)19-17(24)20-16(22)9-8-14-7-4-10-23-14/h3-11H,2H2,1H3,(H,18,21)(H2,19,20,22,24)/b9-8+