methyl 2-(3,6-dimethylquinolin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(3,6-dimethylquinolin-2-yl)sulfanylethanoate Openeye Name: methyl 2-[(3,6-dimethyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(3,6-dimethyl-2-quinolinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3,6-dimethylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(3,6-dimethyl-2-quinolyl)thio]acetic acid methyl ester Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)SCC(=O)OC)C

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)SCC(=O)OC)C

InChI

InChI=1S/C14H15NO2S/c1-9-4-5-12-11(6-9)7-10(2)14(15-12)18-8-13(16)17-3/h4-7H,8H2,1-3H3