6-(4-fluoranyl-3-methyl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: 6-(4-fluoranyl-3-methyl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: 6-(4-fluoro-3-methyl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 6-(4-fluoro-3-methylphenyl)-2-(methylthio)-4-pyrimidinecarboxylate IUPAC Name: 6-(4-fluoro-3-methylphenyl)-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 6-(4-fluoro-3-methyl-phenyl)-2-(methylthio)pyrimidine-4-carboxylate Formula: C13H10FN2O2S- MolecularWeight: 277.294103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=NC(=N2)SC)C(=O)[O-])F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=NC(=N2)SC)C(=O)[O-])F

InChI

InChI=1S/C13H11FN2O2S/c1-7-5-8(3-4-9(7)14)10-6-11(12(17)18)16-13(15-10)19-2/h3-6H,1-2H3,(H,17,18)/p-1