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

Systemtic Name: [3-(6-methoxyquinolin-4-yl)-3-oxidanylidene-propyl] 2-[1-(2-thiophen-2-ylsulfanylethyl)piperidin-3-yl]ethanoate Openeye Name: [3-(6-methoxy-4-quinolyl)-3-oxo-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)-3-oxopropyl] ester IUPAC Name: [3-(6-methoxyquinolin-4-yl)-3-oxopropyl] 2-[1-(2-thiophen-2-ylsulfanylethyl)piperidin-3-yl]acetate Traditional Name: 2-[1-[2-(2-thienylthio)ethyl]-3-piperidyl]acetic acid [3-keto-3-(6-methoxy-4-quinolyl)propyl] ester Formula: C26H30N2O4S2 MolecularWeight: 498.6574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N2O4S2/c1-31-20-6-7-23-22(17-20)21(8-10-27-23)24(29)9-13-32-25(30)16-19-4-2-11-28(18-19)12-15-34-26-5-3-14-33-26/h3,5-8,10,14,17,19H,2,4,9,11-13,15-16,18H2,1H3