methyl 2-(3,7-dimethylquinolin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(3,7-dimethylquinolin-2-yl)sulfanylethanoate Openeye Name: methyl 2-[(3,7-dimethyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(3,7-dimethyl-2-quinolinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3,7-dimethylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(3,7-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=NC(=C(C=C2C=C1)C)SCC(=O)OC

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C)SCC(=O)OC

InChI

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