N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-(2-methylphenyl)ethanamide

Systemtic Name: N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-(2-methylphenyl)ethanamide Openeye Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-(o-tolyl)acetamide CAS Name: N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-2-(2-methylphenyl)acetamide IUPAC Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-(2-methylphenyl)acetamide Traditional Name: N-[benzyl(2-cyanoethyl)thiocarbamoyl]-2-(o-tolyl)acetamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)N(CCC#N)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)N(CCC#N)CC2=CC=CC=C2

InChI

InChI=1S/C20H21N3OS/c1-16-8-5-6-11-18(16)14-19(24)22-20(25)23(13-7-12-21)15-17-9-3-2-4-10-17/h2-6,8-11H,7,13-15H2,1H3,(H,22,24,25)