(2R)-2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]butanamide

Systemtic Name: (2R)-2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]butanamide Openeye Name: (2R)-2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-[(1R)-1-phenylethyl]butanamide CAS Name: (2R)-2-[(3-cyano-6-methyl-2-pyridinyl)thio]-N-[(1R)-1-phenylethyl]butanamide IUPAC Name: (2R)-2-(3-cyano-6-methylpyridin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]butanamide Traditional Name: (2R)-2-[(3-cyano-6-methyl-2-pyridyl)thio]-N-[(1R)-1-phenylethyl]butyramide Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C)C1=CC=CC=C1)SC2=C(C=CC(=N2)C)C#N

Isomeric SMILES

CC[C@H](C(=O)N[C@H](C)C1=CC=CC=C1)SC2=C(C=CC(=N2)C)C#N

InChI

InChI=1S/C19H21N3OS/c1-4-17(24-19-16(12-20)11-10-13(2)21-19)18(23)22-14(3)15-8-6-5-7-9-15/h5-11,14,17H,4H2,1-3H3,(H,22,23)/t14-,17-/m1/s1