4-(4-fluorophenyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylate

Systemtic Name: 4-(4-fluorophenyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylate Openeye Name: 4-(4-fluorophenyl)-2-thioxo-1H-pyrimidine-6-carboxylate CAS Name: 4-(4-fluorophenyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylate IUPAC Name: 4-(4-fluorophenyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-thioxo-1H-pyrimidine-6-carboxylate Formula: C11H6FN2O2S- MolecularWeight: 249.240943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=S)NC(=C2)C(=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=S)NC(=C2)C(=O)[O-])F

InChI

InChI=1S/C11H7FN2O2S/c12-7-3-1-6(2-4-7)8-5-9(10(15)16)14-11(17)13-8/h1-5H,(H,15,16)(H,13,14,17)/p-1