2-[(2-cyanopyridin-4-yl)methylsulfanyl]-N-(4-fluoranyl-3-methyl-phenyl)pyridine-3-carboxamide

Systemtic Name: 2-[(2-cyanopyridin-4-yl)methylsulfanyl]-N-(4-fluoranyl-3-methyl-phenyl)pyridine-3-carboxamide Openeye Name: 2-[(2-cyano-4-pyridyl)methylsulfanyl]-N-(4-fluoro-3-methyl-phenyl)pyridine-3-carboxamide CAS Name: 2-[(2-cyano-4-pyridinyl)methylthio]-N-(4-fluoro-3-methylphenyl)-3-pyridinecarboxamide IUPAC Name: 2-[(2-cyanopyridin-4-yl)methylsulfanyl]-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide Traditional Name: 2-[(2-cyano-4-pyridyl)methylthio]-N-(4-fluoro-3-methyl-phenyl)nicotinamide Formula: C20H15FN4OS MolecularWeight: 378.422703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)C#N)F

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)C#N)F

InChI

InChI=1S/C20H15FN4OS/c1-13-9-15(4-5-18(13)21)25-19(26)17-3-2-7-24-20(17)27-12-14-6-8-23-16(10-14)11-22/h2-10H,12H2,1H3,(H,25,26)