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

Systemtic Name: 3-(6-methoxyquinolin-4-yl)propyl 1-(2-thiophen-2-ylsulfanylethyl)piperidine-3-carboxylate Openeye Name: 3-(6-methoxy-4-quinolyl)propyl 1-[2-(2-thienylsulfanyl)ethyl]piperidine-3-carboxylate CAS Name: 1-[2-(thiophen-2-ylthio)ethyl]-3-piperidinecarboxylic acid 3-(6-methoxy-4-quinolinyl)propyl ester IUPAC Name: 3-(6-methoxyquinolin-4-yl)propyl 1-(2-thiophen-2-ylsulfanylethyl)piperidine-3-carboxylate Traditional Name: 1-[2-(2-thienylthio)ethyl]nipecotic acid 3-(6-methoxy-4-quinolyl)propyl ester Formula: C25H30N2O3S2 MolecularWeight: 470.6473

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)C3CCCN(C3)CCSC4=CC=CS4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)C3CCCN(C3)CCSC4=CC=CS4

InChI

InChI=1S/C25H30N2O3S2/c1-29-21-8-9-23-22(17-21)19(10-11-26-23)6-3-14-30-25(28)20-5-2-12-27(18-20)13-16-32-24-7-4-15-31-24/h4,7-11,15,17,20H,2-3,5-6,12-14,16,18H2,1H3