methyl 2-(6-chloranyl-3-cyano-2-methylsulfanyl-quinolin-4-yl)-2-cyano-ethanoate

Systemtic Name: methyl 2-(6-chloranyl-3-cyano-2-methylsulfanyl-quinolin-4-yl)-2-cyano-ethanoate Openeye Name: methyl 2-(6-chloro-3-cyano-2-methylsulfanyl-4-quinolyl)-2-cyano-acetate CAS Name: 2-[6-chloro-3-cyano-2-(methylthio)-4-quinolinyl]-2-cyanoacetic acid methyl ester IUPAC Name: methyl 2-(6-chloro-3-cyano-2-methylsulfanylquinolin-4-yl)-2-cyanoacetate Traditional Name: 2-[6-chloro-3-cyano-2-(methylthio)-4-quinolyl]-2-cyano-acetic acid methyl ester Formula: C15H10ClN3O2S MolecularWeight: 331.7768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=C(C(=NC2=C1C=C(C=C2)Cl)SC)C#N

Isomeric SMILES

COC(=O)C(C#N)C1=C(C(=NC2=C1C=C(C=C2)Cl)SC)C#N

InChI

InChI=1S/C15H10ClN3O2S/c1-21-15(20)11(7-18)13-9-5-8(16)3-4-12(9)19-14(22-2)10(13)6-17/h3-5,11H,1-2H3