N-(4-fluoranyl-3-methyl-phenyl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(4-fluoranyl-3-methyl-phenyl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(4-fluoro-3-methyl-phenyl)-2-(4-quinolylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(4-fluoro-3-methylphenyl)-2-(4-quinolinylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(4-fluoro-3-methylphenyl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(4-fluoro-3-methyl-phenyl)-2-(4-quinolylmethylthio)nicotinamide Formula: C23H18FN3OS MolecularWeight: 403.471923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC4=CC=CC=C34)F

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC4=CC=CC=C34)F

InChI

InChI=1S/C23H18FN3OS/c1-15-13-17(8-9-20(15)24)27-22(28)19-6-4-11-26-23(19)29-14-16-10-12-25-21-7-3-2-5-18(16)21/h2-13H,14H2,1H3,(H,27,28)