N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]benzamide

Systemtic Name: N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]benzamide Openeye Name: N-[benzyl(2-cyanoethyl)carbamothioyl]benzamide CAS Name: N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[benzyl(2-cyanoethyl)carbamothioyl]benzamide Traditional Name: N-[benzyl(2-cyanoethyl)thiocarbamoyl]benzamide Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3OS/c19-12-7-13-21(14-15-8-3-1-4-9-15)18(23)20-17(22)16-10-5-2-6-11-16/h1-6,8-11H,7,13-14H2,(H,20,22,23)