2-[(6-fluoranylquinolin-8-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(6-fluoranylquinolin-8-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(6-fluoro-8-quinolyl)methylsulfanyl]acetic acid CAS Name: 2-[(6-fluoro-8-quinolinyl)methylthio]acetic acid IUPAC Name: 2-[(6-fluoroquinolin-8-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(6-fluoro-8-quinolyl)methylthio]acetic acid Formula: C12H10FNO2S MolecularWeight: 251.276703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC(=C2N=C1)CSCC(=O)O)F

Isomeric SMILES

C1=CC2=CC(=CC(=C2N=C1)CSCC(=O)O)F

InChI

InChI=1S/C12H10FNO2S/c13-10-4-8-2-1-3-14-12(8)9(5-10)6-17-7-11(15)16/h1-5H,6-7H2,(H,15,16)