2-[3-cyano-4-(3,4-dimethylphenyl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[3-cyano-4-(3,4-dimethylphenyl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[[3-cyano-4-(3,4-dimethylphenyl)-6-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: 2-[[3-cyano-4-(3,4-dimethylphenyl)-6-(trifluoromethyl)-2-pyridinyl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[3-cyano-4-(3,4-dimethylphenyl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[3-cyano-4-(3,4-dimethylphenyl)-6-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C20H18F3N3OS MolecularWeight: 405.43663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NCC=C)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NCC=C)C(F)(F)F)C

InChI

InChI=1S/C20H18F3N3OS/c1-4-7-25-18(27)11-28-19-16(10-24)15(9-17(26-19)20(21,22)23)14-6-5-12(2)13(3)8-14/h4-6,8-9H,1,7,11H2,2-3H3,(H,25,27)