(E)-3-naphthalen-1-yl-N-[[4-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-naphthalen-1-yl-N-[[4-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(1-naphthyl)-N-[[4-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(1-naphthalenyl)-N-[[4-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-naphthalen-1-yl-N-[[4-(propanoylamino)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(1-naphthyl)-N-[(4-propionamidophenyl)thiocarbamoyl]acrylamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H21N3O2S/c1-2-21(27)24-18-11-13-19(14-12-18)25-23(29)26-22(28)15-10-17-8-5-7-16-6-3-4-9-20(16)17/h3-15H,2H2,1H3,(H,24,27)(H2,25,26,28,29)/b15-10+