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

Systemtic Name: 3-(4-methyl-3-propyl-quinolin-2-yl)sulfanylpropanoic acid Openeye Name: 3-[(4-methyl-3-propyl-2-quinolyl)sulfanyl]propanoic acid CAS Name: 3-[(4-methyl-3-propyl-2-quinolinyl)thio]propanoic acid IUPAC Name: 3-(4-methyl-3-propylquinolin-2-yl)sulfanylpropanoic acid Traditional Name: 3-[(4-methyl-3-propyl-2-quinolyl)thio]propionic acid Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=CC=CC=C2N=C1SCCC(=O)O)C

Isomeric SMILES

CCCC1=C(C2=CC=CC=C2N=C1SCCC(=O)O)C

InChI

InChI=1S/C16H19NO2S/c1-3-6-13-11(2)12-7-4-5-8-14(12)17-16(13)20-10-9-15(18)19/h4-5,7-8H,3,6,9-10H2,1-2H3,(H,18,19)