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

Systemtic Name: (E)-N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[benzyl(2-cyanoethyl)carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[benzyl(2-cyanoethyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[benzyl(2-cyanoethyl)thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C18H17N3OS2 MolecularWeight: 355.47708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)C=CC2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C18H17N3OS2/c19-11-5-12-21(14-15-6-2-1-3-7-15)18(23)20-17(22)10-9-16-8-4-13-24-16/h1-4,6-10,13H,5,12,14H2,(H,20,22,23)/b10-9+