(E)-N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide Openeye Name: (E)-N-[benzyl(2-cyanoethyl)carbamothioyl]-3-(1-naphthyl)prop-2-enamide CAS Name: (E)-N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-3-(1-naphthalenyl)-2-propenamide IUPAC Name: (E)-N-[benzyl(2-cyanoethyl)carbamothioyl]-3-naphthalen-1-ylprop-2-enamide Traditional Name: (E)-N-[benzyl(2-cyanoethyl)thiocarbamoyl]-3-(1-naphthyl)acrylamide Formula: C24H21N3OS MolecularWeight: 399.50804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)C=CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)/C=C/C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C24H21N3OS/c25-16-7-17-27(18-19-8-2-1-3-9-19)24(29)26-23(28)15-14-21-12-6-11-20-10-4-5-13-22(20)21/h1-6,8-15H,7,17-18H2,(H,26,28,29)/b15-14+