cyclohexyl 2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoate

Systemtic Name: cyclohexyl 2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoate Openeye Name: cyclohexyl 2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6,8-trimethyl-2-quinolyl)thio]acetic acid cyclohexyl ester Formula: C20H25NO2S MolecularWeight: 343.483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)OC3CCCCC3)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)OC3CCCCC3)C)C

InChI

InChI=1S/C20H25NO2S/c1-13-9-15(3)20-17(10-13)14(2)11-18(21-20)24-12-19(22)23-16-7-5-4-6-8-16/h9-11,16H,4-8,12H2,1-3H3