N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-(1-naphthyl)acetamide CAS Name: N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[benzyl(2-cyanoethyl)thiocarbamoyl]-2-(1-naphthyl)acetamide Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3OS/c24-14-7-15-26(17-18-8-2-1-3-9-18)23(28)25-22(27)16-20-12-6-11-19-10-4-5-13-21(19)20/h1-6,8-13H,7,15-17H2,(H,25,27,28)