(2S)-2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide

Systemtic Name: (2S)-2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Openeye Name: (2S)-2-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]-N-(p-tolyl)propanamide CAS Name: (2S)-2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-N-(4-methylphenyl)propanamide IUPAC Name: (2S)-2-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Traditional Name: (2S)-2-[(3-cyano-4,6-diphenyl-2-pyridyl)thio]-N-(p-tolyl)propionamide Formula: C28H23N3OS MolecularWeight: 449.56672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C28H23N3OS/c1-19-13-15-23(16-14-19)30-27(32)20(2)33-28-25(18-29)24(21-9-5-3-6-10-21)17-26(31-28)22-11-7-4-8-12-22/h3-17,20H,1-2H3,(H,30,32)/t20-/m0/s1