5-(4-fluorophenyl)-2-methylsulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 5-(4-fluorophenyl)-2-methylsulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 5-(4-fluorophenyl)-2-methylsulfanyl-pyrimidine-4-carboxylic acid CAS Name: 5-(4-fluorophenyl)-2-(methylthio)-4-pyrimidinecarboxylic acid IUPAC Name: 5-(4-fluorophenyl)-2-methylsulfanylpyrimidine-4-carboxylic acid Traditional Name: 5-(4-fluorophenyl)-2-(methylthio)pyrimidine-4-carboxylic acid Formula: C12H9FN2O2S MolecularWeight: 264.275463

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)O)C2=CC=C(C=C2)F

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H9FN2O2S/c1-18-12-14-6-9(10(15-12)11(16)17)7-2-4-8(13)5-3-7/h2-6H,1H3,(H,16,17)