4-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3-methoxyphenyl)butanamide

Systemtic Name: 4-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3-methoxyphenyl)butanamide Openeye Name: 4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(3-methoxyphenyl)butanamide CAS Name: 4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(3-methoxyphenyl)butanamide IUPAC Name: 4-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3-methoxyphenyl)butanamide Traditional Name: 4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(3-methoxyphenyl)butyramide Formula: C19H18F3N3O2S MolecularWeight: 409.42533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C19H18F3N3O2S/c1-12-9-16(19(20,21)22)15(11-23)18(24-12)28-8-4-7-17(26)25-13-5-3-6-14(10-13)27-2/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,25,26)