ethyl 7-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 7-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 7-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylate CAS Name: 7-(methylthio)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 4-keto-7-(methylthio)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=O)C=CC(=C2)SC

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=O)C=CC(=C2)SC

InChI

InChI=1S/C13H13NO3S/c1-3-17-13(16)10-7-14-11-6-8(18-2)4-5-9(11)12(10)15/h4-7H,3H2,1-2H3,(H,14,15)