methyl 2-(3-cyanoquinolin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(3-cyanoquinolin-2-yl)sulfanylethanoate Openeye Name: methyl 2-[(3-cyano-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-2-quinolinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3-cyanoquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-2-quinolyl)thio]acetic acid methyl ester Formula: C13H10N2O2S MolecularWeight: 258.2957

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC2=CC=CC=C2C=C1C#N

Isomeric SMILES

COC(=O)CSC1=NC2=CC=CC=C2C=C1C#N

InChI

InChI=1S/C13H10N2O2S/c1-17-12(16)8-18-13-10(7-14)6-9-4-2-3-5-11(9)15-13/h2-6H,8H2,1H3