[2-ethyl-5,6-bis(fluoranyl)-3-methyl-quinolin-4-yl] 2-sulfanylethanoate

Systemtic Name: [2-ethyl-5,6-bis(fluoranyl)-3-methyl-quinolin-4-yl] 2-sulfanylethanoate Openeye Name: (2-ethyl-5,6-difluoro-3-methyl-4-quinolyl) 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid (2-ethyl-5,6-difluoro-3-methyl-4-quinolinyl) ester IUPAC Name: (2-ethyl-5,6-difluoro-3-methylquinolin-4-yl) 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid (2-ethyl-5,6-difluoro-3-methyl-4-quinolyl) ester Formula: C14H13F2NO2S MolecularWeight: 297.320326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C1C)OC(=O)CS)C(=C(C=C2)F)F

Isomeric SMILES

CCC1=NC2=C(C(=C1C)OC(=O)CS)C(=C(C=C2)F)F

InChI

InChI=1S/C14H13F2NO2S/c1-3-9-7(2)14(19-11(18)6-20)12-10(17-9)5-4-8(15)13(12)16/h4-5,20H,3,6H2,1-2H3