N-(6-ethoxyquinolin-5-yl)-2-hexylsulfanyl-decanamide

Systemtic Name: N-(6-ethoxyquinolin-5-yl)-2-hexylsulfanyl-decanamide Openeye Name: N-(6-ethoxy-5-quinolyl)-2-hexylsulfanyl-decanamide CAS Name: N-(6-ethoxy-5-quinolinyl)-2-(hexylthio)decanamide IUPAC Name: N-(6-ethoxyquinolin-5-yl)-2-hexylsulfanyldecanamide Traditional Name: N-(6-ethoxy-5-quinolyl)-2-(hexylthio)capramide Formula: C27H42N2O2S MolecularWeight: 458.69958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)NC1=C(C=CC2=C1C=CC=N2)OCC)SCCCCCC

Isomeric SMILES

CCCCCCCCC(C(=O)NC1=C(C=CC2=C1C=CC=N2)OCC)SCCCCCC

InChI

InChI=1S/C27H42N2O2S/c1-4-7-9-11-12-13-17-25(32-21-14-10-8-5-2)27(30)29-26-22-16-15-20-28-23(22)18-19-24(26)31-6-3/h15-16,18-20,25H,4-14,17,21H2,1-3H3,(H,29,30)