N-(pyridin-2-ylmethyl)-2-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(pyridin-2-ylmethyl)-2-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(2-pyridylmethyl)-2-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethylsulfanyl]pyridine-3-carboxamide CAS Name: N-(2-pyridinylmethyl)-2-[2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]ethylthio]-3-pyridinecarboxamide IUPAC Name: N-(pyridin-2-ylmethyl)-2-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(2-pyridylmethyl)-2-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethylthio]nicotinamide Formula: C20H17F3N4O3S2 MolecularWeight: 482.49919

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)C2=C(N=CC=C2)SCCS(=O)(=O)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)C2=C(N=CC=C2)SCCS(=O)(=O)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H17F3N4O3S2/c21-20(22,23)14-6-7-17(26-12-14)32(29,30)11-10-31-19-16(5-3-9-25-19)18(28)27-13-15-4-1-2-8-24-15/h1-9,12H,10-11,13H2,(H,27,28)