ethyl 6-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-(methylthio)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 4-keto-6-(methylthio)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C13H13NO3S MolecularWeight: 263.31222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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