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

Systemtic Name: 3-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Openeye Name: 3-[[3-cyano-6-(p-tolyl)-2-pyridyl]sulfanyl]-N-(4-fluorophenyl)propanamide CAS Name: 3-[[3-cyano-6-(4-methylphenyl)-2-pyridinyl]thio]-N-(4-fluorophenyl)propanamide IUPAC Name: 3-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Traditional Name: 3-[[3-cyano-6-(p-tolyl)-2-pyridyl]thio]-N-(4-fluorophenyl)propionamide Formula: C22H18FN3OS MolecularWeight: 391.461223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18FN3OS/c1-15-2-4-16(5-3-15)20-11-6-17(14-24)22(26-20)28-13-12-21(27)25-19-9-7-18(23)8-10-19/h2-11H,12-13H2,1H3,(H,25,27)