2-methylpropyl 2-(4,8-dimethylquinolin-2-yl)sulfanylethanoate

Systemtic Name: 2-methylpropyl 2-(4,8-dimethylquinolin-2-yl)sulfanylethanoate Openeye Name: isobutyl 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(4,8-dimethylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4,8-dimethyl-2-quinolyl)thio]acetic acid isobutyl ester Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)OCC(C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)OCC(C)C

InChI

InChI=1S/C17H21NO2S/c1-11(2)9-20-16(19)10-21-15-8-13(4)14-7-5-6-12(3)17(14)18-15/h5-8,11H,9-10H2,1-4H3