methyl 2-(4-fluorophenyl)-3-(2-methylsulfanylpyrimidin-4-yl)-3-oxidanylidene-propanoate

Systemtic Name: methyl 2-(4-fluorophenyl)-3-(2-methylsulfanylpyrimidin-4-yl)-3-oxidanylidene-propanoate Openeye Name: methyl 2-(4-fluorophenyl)-3-(2-methylsulfanylpyrimidin-4-yl)-3-oxo-propanoate CAS Name: 2-(4-fluorophenyl)-3-[2-(methylthio)-4-pyrimidinyl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 2-(4-fluorophenyl)-3-(2-methylsulfanylpyrimidin-4-yl)-3-oxopropanoate Traditional Name: 2-(4-fluorophenyl)-3-keto-3-[2-(methylthio)pyrimidin-4-yl]propionic acid methyl ester Formula: C15H13FN2O3S MolecularWeight: 320.338723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)F)C(=O)C2=NC(=NC=C2)SC

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)F)C(=O)C2=NC(=NC=C2)SC

InChI

InChI=1S/C15H13FN2O3S/c1-21-14(20)12(9-3-5-10(16)6-4-9)13(19)11-7-8-17-15(18-11)22-2/h3-8,12H,1-2H3