(2S)-2-[3-cyano-6-(4-methoxyphenyl)-4-phenyl-pyridin-2-yl]sulfanyl-N-(4-methylphenyl)propanamide

Systemtic Name: (2S)-2-[3-cyano-6-(4-methoxyphenyl)-4-phenyl-pyridin-2-yl]sulfanyl-N-(4-methylphenyl)propanamide Openeye Name: (2S)-2-[[3-cyano-6-(4-methoxyphenyl)-4-phenyl-2-pyridyl]sulfanyl]-N-(p-tolyl)propanamide CAS Name: (2S)-2-[[3-cyano-6-(4-methoxyphenyl)-4-phenyl-2-pyridinyl]thio]-N-(4-methylphenyl)propanamide IUPAC Name: (2S)-2-[3-cyano-6-(4-methoxyphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-(4-methylphenyl)propanamide Traditional Name: (2S)-2-[[3-cyano-6-(4-methoxyphenyl)-4-phenyl-2-pyridyl]thio]-N-(p-tolyl)propionamide Formula: C29H25N3O2S MolecularWeight: 479.5927

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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=C(C=C3)OC)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=C(C=C3)OC)C4=CC=CC=C4)C#N

InChI

InChI=1S/C29H25N3O2S/c1-19-9-13-23(14-10-19)31-28(33)20(2)35-29-26(18-30)25(21-7-5-4-6-8-21)17-27(32-29)22-11-15-24(34-3)16-12-22/h4-17,20H,1-3H3,(H,31,33)/t20-/m0/s1