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

Systemtic Name: 3-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methoxyphenyl)propanamide Openeye Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(4-methoxyphenyl)propanamide CAS Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(4-methoxyphenyl)propanamide IUPAC Name: 3-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methoxyphenyl)propanamide Traditional Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(4-methoxyphenyl)propionamide Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16F3N3O2S/c1-11-9-15(18(19,20)21)14(10-22)17(23-11)27-8-7-16(25)24-12-3-5-13(26-2)6-4-12/h3-6,9H,7-8H2,1-2H3,(H,24,25)