5-chloranyl-2-[(4-fluorophenyl)methylsulfonyl]pyrimidine-4-carboxylic acid

Systemtic Name: 5-chloranyl-2-[(4-fluorophenyl)methylsulfonyl]pyrimidine-4-carboxylic acid Openeye Name: 5-chloro-2-[(4-fluorophenyl)methylsulfonyl]pyrimidine-4-carboxylic acid CAS Name: 5-chloro-2-[(4-fluorophenyl)methylsulfonyl]-4-pyrimidinecarboxylic acid IUPAC Name: 5-chloro-2-[(4-fluorophenyl)methylsulfonyl]pyrimidine-4-carboxylic acid Traditional Name: 5-chloro-2-(4-fluorobenzyl)sulfonyl-pyrimidine-4-carboxylic acid Formula: C12H8ClFN2O4S MolecularWeight: 330.719323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)C2=NC=C(C(=N2)C(=O)O)Cl)F

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)C2=NC=C(C(=N2)C(=O)O)Cl)F

InChI

InChI=1S/C12H8ClFN2O4S/c13-9-5-15-12(16-10(9)11(17)18)21(19,20)6-7-1-3-8(14)4-2-7/h1-5H,6H2,(H,17,18)