sodium 5-[(4-fluorophenyl)carbamoyl]pyrimidine-2-sulfinate

Systemtic Name: sodium 5-[(4-fluorophenyl)carbamoyl]pyrimidine-2-sulfinate Openeye Name: sodium 5-[(4-fluorophenyl)carbamoyl]pyrimidine-2-sulfinate CAS Name: sodium 5-[(4-fluoroanilino)-oxomethyl]-2-pyrimidinesulfinate IUPAC Name: sodium 5-[(4-fluorophenyl)carbamoyl]pyrimidine-2-sulfinate Traditional Name: sodium 5-[(4-fluorophenyl)carbamoyl]pyrimidine-2-sulfinate Formula: C11H7FN3NaO3S MolecularWeight: 303.244753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=CN=C(N=C2)S(=O)[O-])F.[Na+]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CN=C(N=C2)S(=O)[O-])F.[Na+]

InChI

InChI=1S/C11H8FN3O3S.Na/c12-8-1-3-9(4-2-8)15-10(16)7-5-13-11(14-6-7)19(17)18;/h1-6H,(H,15,16)(H,17,18);/q;+1/p-1