4-(3-chlorophenyl)-6-(methoxymethyl)-2-methylsulfanyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-6-(methoxymethyl)-2-methylsulfanyl-pyrimidine-5-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-6-(methoxymethyl)-2-methylsulfanyl-pyrimidine-5-carboxylic acid CAS Name: 4-(3-chlorophenyl)-6-(methoxymethyl)-2-(methylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 4-(3-chlorophenyl)-6-(methoxymethyl)-2-methylsulfanylpyrimidine-5-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-6-(methoxymethyl)-2-(methylthio)pyrimidine-5-carboxylic acid Formula: C14H13ClN2O3S MolecularWeight: 324.78262

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC(=NC(=C1C(=O)O)C2=CC(=CC=C2)Cl)SC

Isomeric SMILES

COCC1=NC(=NC(=C1C(=O)O)C2=CC(=CC=C2)Cl)SC

InChI

InChI=1S/C14H13ClN2O3S/c1-20-7-10-11(13(18)19)12(17-14(16-10)21-2)8-4-3-5-9(15)6-8/h3-6H,7H2,1-2H3,(H,18,19)