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

Systemtic Name: methyl 2-(4-fluorophenyl)-3-(2-methylsulfanylpyrimidin-4-yl)-3-oxidanyl-propanoate Openeye Name: methyl 2-(4-fluorophenyl)-3-hydroxy-3-(2-methylsulfanylpyrimidin-4-yl)propanoate CAS Name: 2-(4-fluorophenyl)-3-hydroxy-3-[2-(methylthio)-4-pyrimidinyl]propanoic acid methyl ester IUPAC Name: methyl 2-(4-fluorophenyl)-3-hydroxy-3-(2-methylsulfanylpyrimidin-4-yl)propanoate Traditional Name: 2-(4-fluorophenyl)-3-hydroxy-3-[2-(methylthio)pyrimidin-4-yl]propionic acid methyl ester Formula: C15H15FN2O3S MolecularWeight: 322.354603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15FN2O3S/c1-21-14(20)12(9-3-5-10(16)6-4-9)13(19)11-7-8-17-15(18-11)22-2/h3-8,12-13,19H,1-2H3