2-[3-cyano-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[3-cyano-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[[6-(4-allyloxyphenyl)-3-cyano-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[3-cyano-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[3-cyano-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[6-(4-allyloxyphenyl)-3-cyano-4-(trifluoromethyl)-2-pyridyl]thio]-N-(4-methoxyphenyl)acetamide Formula: C25H20F3N3O3S MolecularWeight: 499.50481

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20F3N3O3S/c1-3-12-34-19-8-4-16(5-9-19)22-13-21(25(26,27)28)20(14-29)24(31-22)35-15-23(32)30-17-6-10-18(33-2)11-7-17/h3-11,13H,1,12,15H2,2H3,(H,30,32)