(2S)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-[(4-phenylphenyl)amino]propanamide

Systemtic Name: (2S)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-[(4-phenylphenyl)amino]propanamide Openeye Name: (2S)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-(4-phenylanilino)propanamide CAS Name: (2S)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-(4-phenylanilino)propanamide IUPAC Name: (2S)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-(4-phenylanilino)propanamide Traditional Name: (2S)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-(4-phenylanilino)propionamide Formula: C21H25N3O MolecularWeight: 335.4427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C(C)NC1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)N[C@@](C)(C#N)C(C)C)NC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H25N3O/c1-15(2)21(4,14-22)24-20(25)16(3)23-19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13,15-16,23H,1-4H3,(H,24,25)/t16-,21-/m0/s1