2-[2-(4-fluorophenyl)quinazolin-4-yl]sulfanylethanoic acid

Systemtic Name: 2-[2-(4-fluorophenyl)quinazolin-4-yl]sulfanylethanoic acid Openeye Name: 2-[2-(4-fluorophenyl)quinazolin-4-yl]sulfanylacetic acid CAS Name: 2-[[2-(4-fluorophenyl)-4-quinazolinyl]thio]acetic acid IUPAC Name: 2-[2-(4-fluorophenyl)quinazolin-4-yl]sulfanylacetic acid Traditional Name: 2-[[2-(4-fluorophenyl)quinazolin-4-yl]thio]acetic acid Formula: C16H11FN2O2S MolecularWeight: 314.334143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)F)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)F)SCC(=O)O

InChI

InChI=1S/C16H11FN2O2S/c17-11-7-5-10(6-8-11)15-18-13-4-2-1-3-12(13)16(19-15)22-9-14(20)21/h1-8H,9H2,(H,20,21)