2-(2-methyl-3-propyl-quinolin-4-yl)sulfanylethanoic acid

Systemtic Name: 2-(2-methyl-3-propyl-quinolin-4-yl)sulfanylethanoic acid Openeye Name: 2-[(2-methyl-3-propyl-4-quinolyl)sulfanyl]acetic acid CAS Name: 2-[(2-methyl-3-propyl-4-quinolinyl)thio]acetic acid IUPAC Name: 2-(2-methyl-3-propylquinolin-4-yl)sulfanylacetic acid Traditional Name: 2-[(2-methyl-3-propyl-4-quinolyl)thio]acetic acid Formula: C15H17NO2S MolecularWeight: 275.36598

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=CC=CC=C2N=C1C)SCC(=O)O

Isomeric SMILES

CCCC1=C(C2=CC=CC=C2N=C1C)SCC(=O)O

InChI

InChI=1S/C15H17NO2S/c1-3-6-11-10(2)16-13-8-5-4-7-12(13)15(11)19-9-14(17)18/h4-5,7-8H,3,6,9H2,1-2H3,(H,17,18)