[3-(6-methoxyquinolin-4-yl)-3-oxidanylidene-propyl] 1-[2-(1,3-thiazol-2-ylsulfanyl)ethyl]piperidine-3-carboxylate

Systemtic Name: [3-(6-methoxyquinolin-4-yl)-3-oxidanylidene-propyl] 1-[2-(1,3-thiazol-2-ylsulfanyl)ethyl]piperidine-3-carboxylate Openeye Name: [3-(6-methoxy-4-quinolyl)-3-oxo-propyl] 1-(2-thiazol-2-ylsulfanylethyl)piperidine-3-carboxylate CAS Name: 1-[2-(2-thiazolylthio)ethyl]-3-piperidinecarboxylic acid [3-(6-methoxy-4-quinolinyl)-3-oxopropyl] ester IUPAC Name: [3-(6-methoxyquinolin-4-yl)-3-oxopropyl] 1-[2-(1,3-thiazol-2-ylsulfanyl)ethyl]piperidine-3-carboxylate Traditional Name: 1-[2-(thiazol-2-ylthio)ethyl]nipecotic acid [3-keto-3-(6-methoxy-4-quinolyl)propyl] ester Formula: C24H27N3O4S2 MolecularWeight: 485.61888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(=O)CCOC(=O)C3CCCN(C3)CCSC4=NC=CS4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(=O)CCOC(=O)C3CCCN(C3)CCSC4=NC=CS4

InChI

InChI=1S/C24H27N3O4S2/c1-30-18-4-5-21-20(15-18)19(6-8-25-21)22(28)7-12-31-23(29)17-3-2-10-27(16-17)11-14-33-24-26-9-13-32-24/h4-6,8-9,13,15,17H,2-3,7,10-12,14,16H2,1H3