methyl 1-(2-quinolin-2-ylsulfanylethanoyl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(2-quinolin-2-ylsulfanylethanoyl)piperidine-4-carboxylate Openeye Name: methyl 1-[2-(2-quinolylsulfanyl)acetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-(2-quinolinylthio)ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-quinolin-2-ylsulfanylacetyl)piperidine-4-carboxylate Traditional Name: 1-[2-(2-quinolylthio)acetyl]isonipecotic acid methyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H20N2O3S/c1-23-18(22)14-8-10-20(11-9-14)17(21)12-24-16-7-6-13-4-2-3-5-15(13)19-16/h2-7,14H,8-12H2,1H3