3-(6-methoxyquinolin-4-yl)propyl 1-(2-pyridin-2-ylsulfanylethyl)piperidine-3-carboxylate

Systemtic Name: 3-(6-methoxyquinolin-4-yl)propyl 1-(2-pyridin-2-ylsulfanylethyl)piperidine-3-carboxylate Openeye Name: 3-(6-methoxy-4-quinolyl)propyl 1-[2-(2-pyridylsulfanyl)ethyl]piperidine-3-carboxylate CAS Name: 1-[2-(2-pyridinylthio)ethyl]-3-piperidinecarboxylic acid 3-(6-methoxy-4-quinolinyl)propyl ester IUPAC Name: 3-(6-methoxyquinolin-4-yl)propyl 1-(2-pyridin-2-ylsulfanylethyl)piperidine-3-carboxylate Traditional Name: 1-[2-(2-pyridylthio)ethyl]nipecotic acid 3-(6-methoxy-4-quinolyl)propyl ester Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)C3CCCN(C3)CCSC4=CC=CC=N4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)C3CCCN(C3)CCSC4=CC=CC=N4

InChI

InChI=1S/C26H31N3O3S/c1-31-22-9-10-24-23(18-22)20(11-13-27-24)7-5-16-32-26(30)21-6-4-14-29(19-21)15-17-33-25-8-2-3-12-28-25/h2-3,8-13,18,21H,4-7,14-17,19H2,1H3