2-methylsulfonyl-4-phenyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-methylsulfonyl-4-phenyl-pyrimidine-5-carboxylic acid Openeye Name: 2-methylsulfonyl-4-phenyl-pyrimidine-5-carboxylic acid CAS Name: 2-methylsulfonyl-4-phenyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-methylsulfonyl-4-phenylpyrimidine-5-carboxylic acid Traditional Name: 2-mesyl-4-phenyl-pyrimidine-5-carboxylic acid Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C12H10N2O4S/c1-19(17,18)12-13-7-9(11(15)16)10(14-12)8-5-3-2-4-6-8/h2-7H,1H3,(H,15,16)