(2S)-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-methyl-N-(phenylmethyl)propanamide

Systemtic Name: (2S)-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-methyl-N-(phenylmethyl)propanamide Openeye Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-benzyl-N-methyl-propanamide CAS Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-methyl-N-(phenylmethyl)propanamide IUPAC Name: (2S)-2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-benzyl-N-methylpropanamide Traditional Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-benzyl-N-methyl-propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SC(C)C(=O)N(C)CC2=CC=CC=C2)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)S[C@@H](C)C(=O)N(C)CC2=CC=CC=C2)C#N)C(=O)C

InChI

InChI=1S/C20H21N3O2S/c1-13-18(14(2)24)10-17(11-21)19(22-13)26-15(3)20(25)23(4)12-16-8-6-5-7-9-16/h5-10,15H,12H2,1-4H3/t15-/m0/s1