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

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(4-chloro-2-fluorophenyl)-2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]thio]acetamide Formula: C21H15ClFN3O2S MolecularWeight: 427.879103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15ClFN3O2S/c1-28-16-4-2-3-13(9-16)18-7-5-14(11-24)21(26-18)29-12-20(27)25-19-8-6-15(22)10-17(19)23/h2-10H,12H2,1H3,(H,25,27)