2-(4-chlorophenyl)-N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]ethanamide Openeye Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-(4-chlorophenyl)acetamide CAS Name: 2-(4-chlorophenyl)-N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]acetamide IUPAC Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: N-[benzyl(2-cyanoethyl)thiocarbamoyl]-2-(4-chlorophenyl)acetamide Formula: C19H18ClN3OS MolecularWeight: 371.88372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H18ClN3OS/c20-17-9-7-15(8-10-17)13-18(24)22-19(25)23(12-4-11-21)14-16-5-2-1-3-6-16/h1-3,5-10H,4,12-14H2,(H,22,24,25)