2-[(4-fluorophenyl)sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(4-fluorophenyl)sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(4-fluorophenyl)sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(4-fluorophenyl)thio]methyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(4-fluorophenyl)sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[(4-fluorophenyl)thio]methyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C16H10FN2O3S- MolecularWeight: 329.325603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)SCC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1F)SCC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H11FN2O3S/c17-10-2-4-11(5-3-10)23-8-14-18-13-7-9(16(21)22)1-6-12(13)15(20)19-14/h1-7H,8H2,(H,21,22)(H,18,19,20)/p-1