N-quinolin-5-yl-2-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-quinolin-5-yl-2-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(5-quinolyl)-2-(2,2,2-trifluoroethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(5-quinolinyl)-2-(2,2,2-trifluoroethylthio)-3-pyridinecarboxamide IUPAC Name: N-quinolin-5-yl-2-(2,2,2-trifluoroethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(5-quinolyl)-2-(2,2,2-trifluoroethylthio)nicotinamide Formula: C17H12F3N3OS MolecularWeight: 363.35689

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC(=O)C3=C(N=CC=C3)SCC(F)(F)F

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC(=O)C3=C(N=CC=C3)SCC(F)(F)F

InChI

InChI=1S/C17H12F3N3OS/c18-17(19,20)10-25-16-12(5-3-9-22-16)15(24)23-14-7-1-6-13-11(14)4-2-8-21-13/h1-9H,10H2,(H,23,24)