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

Systemtic Name: 4-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methoxyphenyl)butanamide Openeye Name: 4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(4-methoxyphenyl)butanamide CAS Name: 4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(4-methoxyphenyl)butanamide IUPAC Name: 4-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methoxyphenyl)butanamide Traditional Name: 4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(4-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=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H18F3N3O2S/c1-12-10-16(19(20,21)22)15(11-23)18(24-12)28-9-3-4-17(26)25-13-5-7-14(27-2)8-6-13/h5-8,10H,3-4,9H2,1-2H3,(H,25,26)