6-(4-methoxy-3-methyl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 6-(4-methoxy-3-methyl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 6-(4-methoxy-3-methyl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxylic acid CAS Name: 6-(4-methoxy-3-methylphenyl)-2-(methylthio)-4-pyrimidinecarboxylic acid IUPAC Name: 6-(4-methoxy-3-methylphenyl)-2-methylsulfanylpyrimidine-4-carboxylic acid Traditional Name: 6-(4-methoxy-3-methyl-phenyl)-2-(methylthio)pyrimidine-4-carboxylic acid Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=NC(=N2)SC)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=NC(=N2)SC)C(=O)O)OC

InChI

InChI=1S/C14H14N2O3S/c1-8-6-9(4-5-12(8)19-2)10-7-11(13(17)18)16-14(15-10)20-3/h4-7H,1-3H3,(H,17,18)