2-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)butanamide

Systemtic Name: 2-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)butanamide Openeye Name: 2-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(3,5-dimethylphenyl)butanamide CAS Name: 2-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]thio]-N-(3,5-dimethylphenyl)butanamide IUPAC Name: 2-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)butanamide Traditional Name: 2-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]thio]-N-(3,5-dimethylphenyl)butyramide Formula: C31H29N3OS MolecularWeight: 491.64646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC(=C1)C)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC(=C1)C)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)C)C#N

InChI

InChI=1S/C31H29N3OS/c1-5-29(30(35)33-25-16-21(3)15-22(4)17-25)36-31-27(19-32)26(23-13-11-20(2)12-14-23)18-28(34-31)24-9-7-6-8-10-24/h6-18,29H,5H2,1-4H3,(H,33,35)