ethyl 3-cyano-2-methylsulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate

Systemtic Name: ethyl 3-cyano-2-methylsulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate Openeye Name: ethyl 3-cyano-2-methylsulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate CAS Name: 3-cyano-2-(methylthio)-5,6,7,8-tetrahydroquinoline-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-methylsulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate Traditional Name: 3-cyano-2-(methylthio)-5,6,7,8-tetrahydroquinoline-4-carboxylic acid ethyl ester Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NC2=C1CCCC2)SC)C#N

Isomeric SMILES

CCOC(=O)C1=C(C(=NC2=C1CCCC2)SC)C#N

InChI

InChI=1S/C14H16N2O2S/c1-3-18-14(17)12-9-6-4-5-7-11(9)16-13(19-2)10(12)8-15/h3-7H2,1-2H3