(2S,3S)-2-azanyl-N-(4-cyanophenyl)-3-methyl-pentanamide

Systemtic Name: (2S,3S)-2-azanyl-N-(4-cyanophenyl)-3-methyl-pentanamide Openeye Name: (2S,3S)-2-amino-N-(4-cyanophenyl)-3-methyl-pentanamide CAS Name: (2S,3S)-2-amino-N-(4-cyanophenyl)-3-methylpentanamide IUPAC Name: (2S,3S)-2-amino-N-(4-cyanophenyl)-3-methylpentanamide Traditional Name: (2S,3S)-2-amino-N-(4-cyanophenyl)-3-methyl-valeramide Formula: C13H17N3O MolecularWeight: 231.29358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)C#N)N

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-3-9(2)12(15)13(17)16-11-6-4-10(8-14)5-7-11/h4-7,9,12H,3,15H2,1-2H3,(H,16,17)/t9-,12-/m0/s1