2-[[2-(2-chlorophenyl)-7-fluoranyl-quinolin-4-yl]carbothioyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[2-(2-chlorophenyl)-7-fluoranyl-quinolin-4-yl]carbothioyl-methyl-amino]ethanoic acid Openeye Name: 2-[[2-(2-chlorophenyl)-7-fluoro-quinoline-4-carbothioyl]-methyl-amino]acetic acid CAS Name: 2-[[[2-(2-chlorophenyl)-7-fluoro-4-quinolinyl]-sulfanylidenemethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-(2-chlorophenyl)-7-fluoroquinoline-4-carbothioyl]-methylamino]acetic acid Traditional Name: 2-[[2-(2-chlorophenyl)-7-fluoro-quinoline-4-carbothioyl]-methyl-amino]acetic acid Formula: C19H14ClFN2O2S MolecularWeight: 388.843063

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=S)C1=CC(=NC2=C1C=CC(=C2)F)C3=CC=CC=C3Cl

Isomeric SMILES

CN(CC(=O)O)C(=S)C1=CC(=NC2=C1C=CC(=C2)F)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H14ClFN2O2S/c1-23(10-18(24)25)19(26)14-9-17(13-4-2-3-5-15(13)20)22-16-8-11(21)6-7-12(14)16/h2-9H,10H2,1H3,(H,24,25)