2,2,6,6-tetramethyl-5-methylsulfanyl-4-[2-methyl-6-(trifluoromethyl)pyridin-3-yl]carbonyl-cyclohex-4-ene-1,3-dione

Systemtic Name: 2,2,6,6-tetramethyl-5-methylsulfanyl-4-[2-methyl-6-(trifluoromethyl)pyridin-3-yl]carbonyl-cyclohex-4-ene-1,3-dione Openeye Name: 2,2,6,6-tetramethyl-5-methylsulfanyl-4-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]cyclohex-4-ene-1,3-dione CAS Name: 2,2,6,6-tetramethyl-5-(methylthio)-4-[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]-oxomethyl]cyclohex-4-ene-1,3-dione IUPAC Name: 2,2,6,6-tetramethyl-5-methylsulfanyl-4-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]cyclohex-4-ene-1,3-dione Traditional Name: 2,2,6,6-tetramethyl-5-(methylthio)-4-[2-methyl-6-(trifluoromethyl)nicotinoyl]cyclohex-4-ene-1,3-quinone Formula: C19H20F3NO3S MolecularWeight: 399.42721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C(F)(F)F)C(=O)C2=C(C(C(=O)C(C2=O)(C)C)(C)C)SC

Isomeric SMILES

CC1=C(C=CC(=N1)C(F)(F)F)C(=O)C2=C(C(C(=O)C(C2=O)(C)C)(C)C)SC

InChI

InChI=1S/C19H20F3NO3S/c1-9-10(7-8-11(23-9)19(20,21)22)13(24)12-14(25)17(2,3)16(26)18(4,5)15(12)27-6/h7-8H,1-6H3