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

Systemtic Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Openeye Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(4-fluorophenyl)propanamide CAS Name: 3-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]thio]-N-(4-fluorophenyl)propanamide IUPAC Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Traditional Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]thio]-N-(4-fluorophenyl)propionamide Formula: C28H22FN3OS MolecularWeight: 467.557183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C28H22FN3OS/c1-19-7-9-20(10-8-19)24-17-26(21-5-3-2-4-6-21)32-28(25(24)18-30)34-16-15-27(33)31-23-13-11-22(29)12-14-23/h2-14,17H,15-16H2,1H3,(H,31,33)