N-[2-oxidanylidene-2-(propylamino)ethyl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-(propylamino)ethyl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-oxo-2-(propylamino)ethyl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-pyridine-3-carboxamide CAS Name: N-[2-oxo-2-(propylamino)ethyl]-2-[[3-(trifluoromethyl)phenyl]thio]-3-pyridinecarboxamide IUPAC Name: N-[2-oxo-2-(propylamino)ethyl]-2-[3-(trifluoromethyl)phenyl]sulfanylpyridine-3-carboxamide Traditional Name: N-[2-keto-2-(propylamino)ethyl]-2-[[3-(trifluoromethyl)phenyl]thio]nicotinamide Formula: C18H18F3N3O2S MolecularWeight: 397.41463

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C1=C(N=CC=C1)SC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCNC(=O)CNC(=O)C1=C(N=CC=C1)SC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O2S/c1-2-8-22-15(25)11-24-16(26)14-7-4-9-23-17(14)27-13-6-3-5-12(10-13)18(19,20)21/h3-7,9-10H,2,8,11H2,1H3,(H,22,25)(H,24,26)