2-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylhexanoic acid

Systemtic Name: 2-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylhexanoic acid Openeye Name: 2-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanylhexanoic acid CAS Name: 2-[[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]thio]hexanoic acid IUPAC Name: 2-[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylhexanoic acid Traditional Name: 2-[[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]thio]hexanoic acid Formula: C20H19FN2O3S MolecularWeight: 386.439863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F

Isomeric SMILES

CCCCC(C(=O)O)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN2O3S/c1-2-3-8-17(19(25)26)27-20-22-16-7-5-4-6-15(16)18(24)23(20)14-11-9-13(21)10-12-14/h4-7,9-12,17H,2-3,8H2,1H3,(H,25,26)