ethyl 3-cyano-2-(4-methylsulfanylphenyl)-4-oxidanylidene-quinolizine-1-carboxylate

Systemtic Name: ethyl 3-cyano-2-(4-methylsulfanylphenyl)-4-oxidanylidene-quinolizine-1-carboxylate Openeye Name: ethyl 3-cyano-2-(4-methylsulfanylphenyl)-4-oxo-quinolizine-1-carboxylate CAS Name: 3-cyano-2-[4-(methylthio)phenyl]-4-oxo-1-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-(4-methylsulfanylphenyl)-4-oxoquinolizine-1-carboxylate Traditional Name: 3-cyano-4-keto-2-[4-(methylthio)phenyl]quinolizine-1-carboxylic acid ethyl ester Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1C3=CC=C(C=C3)SC)C#N

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1C3=CC=C(C=C3)SC)C#N

InChI

InChI=1S/C20H16N2O3S/c1-3-25-20(24)18-16-6-4-5-11-22(16)19(23)15(12-21)17(18)13-7-9-14(26-2)10-8-13/h4-11H,3H2,1-2H3