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

Systemtic Name: 3-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3,4-dimethoxyphenyl)propanamide Openeye Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(3,4-dimethoxyphenyl)propanamide CAS Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: 3-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(3,4-dimethoxyphenyl)propionamide Formula: C19H18F3N3O3S MolecularWeight: 425.42473

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H18F3N3O3S/c1-11-8-14(19(20,21)22)13(10-23)18(24-11)29-7-6-17(26)25-12-4-5-15(27-2)16(9-12)28-3/h4-5,8-9H,6-7H2,1-3H3,(H,25,26)