4-[6-tert-butyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3-methylphenyl)butanamide

Systemtic Name: 4-[6-tert-butyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3-methylphenyl)butanamide Openeye Name: 4-[[6-tert-butyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(m-tolyl)butanamide CAS Name: 4-[[6-tert-butyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(3-methylphenyl)butanamide IUPAC Name: 4-[6-tert-butyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3-methylphenyl)butanamide Traditional Name: 4-[[6-tert-butyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]thio]-N-(m-tolyl)butyramide Formula: C22H24F3N3OS MolecularWeight: 435.50567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCCSC2=C(C(=CC(=N2)C(C)(C)C)C(F)(F)F)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCCSC2=C(C(=CC(=N2)C(C)(C)C)C(F)(F)F)C#N

InChI

InChI=1S/C22H24F3N3OS/c1-14-7-5-8-15(11-14)27-19(29)9-6-10-30-20-16(13-26)17(22(23,24)25)12-18(28-20)21(2,3)4/h5,7-8,11-12H,6,9-10H2,1-4H3,(H,27,29)