2-methylsulfonyl-5-naphthalen-2-yl-pyrimidine-4-carboxylic acid

Systemtic Name: 2-methylsulfonyl-5-naphthalen-2-yl-pyrimidine-4-carboxylic acid Openeye Name: 2-methylsulfonyl-5-(2-naphthyl)pyrimidine-4-carboxylic acid CAS Name: 2-methylsulfonyl-5-(2-naphthalenyl)-4-pyrimidinecarboxylic acid IUPAC Name: 2-methylsulfonyl-5-naphthalen-2-ylpyrimidine-4-carboxylic acid Traditional Name: 2-mesyl-5-(2-naphthyl)pyrimidine-4-carboxylic acid Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C16H12N2O4S/c1-23(21,22)16-17-9-13(14(18-16)15(19)20)12-7-6-10-4-2-3-5-11(10)8-12/h2-9H,1H3,(H,19,20)