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

Systemtic Name: 2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]sulfanyl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridinyl]thio]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]thio]-N-(4-fluorophenyl)acetamide Formula: C21H16FN3O2S MolecularWeight: 393.434043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16FN3O2S/c1-27-18-4-2-3-14(11-18)19-10-5-15(12-23)21(25-19)28-13-20(26)24-17-8-6-16(22)7-9-17/h2-11H,13H2,1H3,(H,24,26)