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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SC(C)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)S[C@H](C)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H23N3OS/c1-19-13-15-22(16-14-19)26-17-24(21-9-5-3-6-10-21)25(18-29)28(31-26)33-20(2)27(32)30-23-11-7-4-8-12-23/h3-17,20H,1-2H3,(H,30,32)/t20-/m1/s1