N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-methyl-propanamide Openeye Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-methyl-propanamide CAS Name: N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-methylpropanamide Traditional Name: N-[benzyl(2-cyanoethyl)thiocarbamoyl]-2-methyl-propionamide Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)N(CCC#N)CC1=CC=CC=C1

Isomeric SMILES

CC(C)C(=O)NC(=S)N(CCC#N)CC1=CC=CC=C1

InChI

InChI=1S/C15H19N3OS/c1-12(2)14(19)17-15(20)18(10-6-9-16)11-13-7-4-3-5-8-13/h3-5,7-8,12H,6,10-11H2,1-2H3,(H,17,19,20)