(2S)-2-[[(1S,2S)-2-azanyl-1-cyano-3-phenyl-propyl]amino]-4-methyl-pentanamide

Systemtic Name: (2S)-2-[[(1S,2S)-2-azanyl-1-cyano-3-phenyl-propyl]amino]-4-methyl-pentanamide Openeye Name: (2S)-2-[[(1S,2S)-2-amino-1-cyano-3-phenyl-propyl]amino]-4-methyl-pentanamide CAS Name: (2S)-2-[[(1S,2S)-2-amino-1-cyano-3-phenylpropyl]amino]-4-methylpentanamide IUPAC Name: (2S)-2-[[(1S,2S)-2-amino-1-cyano-3-phenylpropyl]amino]-4-methylpentanamide Traditional Name: (2S)-2-[[(1S,2S)-2-amino-1-cyano-3-phenyl-propyl]amino]-4-methyl-valeramide Formula: C16H24N4O MolecularWeight: 288.38796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)N[C@H](C#N)[C@H](CC1=CC=CC=C1)N

InChI

InChI=1S/C16H24N4O/c1-11(2)8-14(16(19)21)20-15(10-17)13(18)9-12-6-4-3-5-7-12/h3-7,11,13-15,20H,8-9,18H2,1-2H3,(H2,19,21)/t13-,14-,15+/m0/s1