ethyl 2-(3-cyanoquinolin-4-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(3-cyanoquinolin-4-yl)sulfanylethanoate Openeye Name: ethyl 2-[(3-cyano-4-quinolyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4-quinolinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-cyanoquinolin-4-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-4-quinolyl)thio]acetic acid ethyl ester Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=NC2=CC=CC=C21)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(C=NC2=CC=CC=C21)C#N

InChI

InChI=1S/C14H12N2O2S/c1-2-18-13(17)9-19-14-10(7-15)8-16-12-6-4-3-5-11(12)14/h3-6,8H,2,9H2,1H3