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

Systemtic Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3-methylpyridin-2-yl)propanamide Openeye Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(3-methyl-2-pyridyl)propanamide CAS Name: 3-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]thio]-N-(3-methyl-2-pyridinyl)propanamide IUPAC Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3-methylpyridin-2-yl)propanamide Traditional Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]thio]-N-(3-methyl-2-pyridyl)propionamide Formula: C28H24N4OS MolecularWeight: 464.58136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=CC=N3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=CC=N3)C)C4=CC=CC=C4

InChI

InChI=1S/C28H24N4OS/c1-19-10-12-21(13-11-19)23-17-25(22-8-4-3-5-9-22)31-28(24(23)18-29)34-16-14-26(33)32-27-20(2)7-6-15-30-27/h3-13,15,17H,14,16H2,1-2H3,(H,30,32,33)