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

Systemtic Name: 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide CAS Name: 2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(3,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(3,4-dimethoxyphenyl)acetamide Traditional Name: 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]-N-(3,4-dimethoxyphenyl)acetamide Formula: C21H16F3N3O3S2 MolecularWeight: 479.49525

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N)OC

InChI

InChI=1S/C21H16F3N3O3S2/c1-29-16-6-5-12(8-17(16)30-2)26-19(28)11-32-20-13(10-25)14(21(22,23)24)9-15(27-20)18-4-3-7-31-18/h3-9H,11H2,1-2H3,(H,26,28)