methyl 2-quinolin-8-ylsulfanylpropanoate

Systemtic Name: methyl 2-quinolin-8-ylsulfanylpropanoate Openeye Name: methyl 2-(8-quinolylsulfanyl)propanoate CAS Name: 2-(8-quinolinylthio)propanoic acid methyl ester IUPAC Name: methyl 2-quinolin-8-ylsulfanylpropanoate Traditional Name: 2-(8-quinolylthio)propionic acid methyl ester Formula: C13H13NO2S MolecularWeight: 247.31282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=CC=CC2=C1N=CC=C2

Isomeric SMILES

CC(C(=O)OC)SC1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C13H13NO2S/c1-9(13(15)16-2)17-11-7-3-5-10-6-4-8-14-12(10)11/h3-9H,1-2H3