3-(6-methoxyquinolin-4-yl)propyl 2-[1-(2-thiophen-2-ylsulfanylethyl)piperidin-3-yl]ethanoate

Systemtic Name: 3-(6-methoxyquinolin-4-yl)propyl 2-[1-(2-thiophen-2-ylsulfanylethyl)piperidin-3-yl]ethanoate Openeye Name: 3-(6-methoxy-4-quinolyl)propyl 2-[1-[2-(2-thienylsulfanyl)ethyl]-3-piperidyl]acetate CAS Name: 2-[1-[2-(thiophen-2-ylthio)ethyl]-3-piperidinyl]acetic acid 3-(6-methoxy-4-quinolinyl)propyl ester IUPAC Name: 3-(6-methoxyquinolin-4-yl)propyl 2-[1-(2-thiophen-2-ylsulfanylethyl)piperidin-3-yl]acetate Traditional Name: 2-[1-[2-(2-thienylthio)ethyl]-3-piperidyl]acetic acid 3-(6-methoxy-4-quinolyl)propyl ester Formula: C26H32N2O3S2 MolecularWeight: 484.67388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)CC3CCCN(C3)CCSC4=CC=CS4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)CC3CCCN(C3)CCSC4=CC=CS4

InChI

InChI=1S/C26H32N2O3S2/c1-30-22-8-9-24-23(18-22)21(10-11-27-24)6-3-14-31-25(29)17-20-5-2-12-28(19-20)13-16-33-26-7-4-15-32-26/h4,7-11,15,18,20H,2-3,5-6,12-14,16-17,19H2,1H3