methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfanylmethyl]-6-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfanylmethyl]-6-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfanylmethyl]-6-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 2-[[(4,6-dimethoxy-2-pyrimidinyl)thio]methyl]-6-(trifluoromethyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfanylmethyl]-6-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 2-[[(4,6-dimethoxypyrimidin-2-yl)thio]methyl]-6-(trifluoromethyl)nicotinic acid methyl ester Formula: C15H14F3N3O4S MolecularWeight: 389.34957

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SCC2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SCC2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC

InChI

InChI=1S/C15H14F3N3O4S/c1-23-11-6-12(24-2)21-14(20-11)26-7-9-8(13(22)25-3)4-5-10(19-9)15(16,17)18/h4-6H,7H2,1-3H3