2-(3-ethyl-2-methyl-quinolin-4-yl)sulfanylethanoate

Systemtic Name: 2-(3-ethyl-2-methyl-quinolin-4-yl)sulfanylethanoate Openeye Name: 2-[(3-ethyl-2-methyl-4-quinolyl)sulfanyl]acetate CAS Name: 2-[(3-ethyl-2-methyl-4-quinolinyl)thio]acetate IUPAC Name: 2-(3-ethyl-2-methylquinolin-4-yl)sulfanylacetate Traditional Name: 2-[(3-ethyl-2-methyl-4-quinolyl)thio]acetate Formula: C14H14NO2S- MolecularWeight: 260.33146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N=C1C)SCC(=O)[O-]

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N=C1C)SCC(=O)[O-]

InChI

InChI=1S/C14H15NO2S/c1-3-10-9(2)15-12-7-5-4-6-11(12)14(10)18-8-13(16)17/h4-7H,3,8H2,1-2H3,(H,16,17)/p-1