(2R)-N-(2-cyanoethyl)-2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-phenyl-propanamide

Systemtic Name: (2R)-N-(2-cyanoethyl)-2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-phenyl-propanamide Openeye Name: (2R)-N-(2-cyanoethyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-phenyl-propanamide CAS Name: (2R)-N-(2-cyanoethyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-phenylpropanamide IUPAC Name: (2R)-N-(2-cyanoethyl)-2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-phenylpropanamide Traditional Name: (2R)-N-(2-cyanoethyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-phenyl-propionamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SC(C)C(=O)N(CCC#N)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)S[C@H](C)C(=O)N(CCC#N)C2=CC=CC=C2)C

InChI

InChI=1S/C21H22N4OS/c1-14-15(2)19(13-23)20(24-16(14)3)27-17(4)21(26)25(12-8-11-22)18-9-6-5-7-10-18/h5-7,9-10,17H,8,12H2,1-4H3/t17-/m1/s1