N-(1-cyano-3-methylsulfanyl-propyl)-4-methyl-2-(3-phenylphenyl)pentanamide

Systemtic Name: N-(1-cyano-3-methylsulfanyl-propyl)-4-methyl-2-(3-phenylphenyl)pentanamide Openeye Name: N-(1-cyano-3-methylsulfanyl-propyl)-4-methyl-2-(3-phenylphenyl)pentanamide CAS Name: N-[1-cyano-3-(methylthio)propyl]-4-methyl-2-(3-phenylphenyl)pentanamide IUPAC Name: N-(1-cyano-3-methylsulfanylpropyl)-4-methyl-2-(3-phenylphenyl)pentanamide Traditional Name: N-[1-cyano-3-(methylthio)propyl]-4-methyl-2-(3-phenylphenyl)valeramide Formula: C23H28N2OS MolecularWeight: 380.54622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=CC=C2)C(=O)NC(CCSC)C#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=CC=C2)C(=O)NC(CCSC)C#N

InChI

InChI=1S/C23H28N2OS/c1-17(2)14-22(23(26)25-21(16-24)12-13-27-3)20-11-7-10-19(15-20)18-8-5-4-6-9-18/h4-11,15,17,21-22H,12-14H2,1-3H3,(H,25,26)