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

Systemtic Name: 3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Openeye Name: 3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]sulfanyl]-N-(4-fluorophenyl)propanamide CAS Name: 3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]thio]-N-(4-fluorophenyl)propanamide IUPAC Name: 3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Traditional Name: 3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]thio]-N-(4-fluorophenyl)propionamide Formula: C22H18FN3O2S MolecularWeight: 407.460623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H18FN3O2S/c1-28-19-9-2-15(3-10-19)20-11-4-16(14-24)22(26-20)29-13-12-21(27)25-18-7-5-17(23)6-8-18/h2-11H,12-13H2,1H3,(H,25,27)