ethyl 7-bromanyl-1-(4-fluorophenyl)-2-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-bromanyl-1-(4-fluorophenyl)-2-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-bromo-1-(4-fluorophenyl)-2-methylsulfanyl-4-oxo-quinoline-3-carboxylate CAS Name: 7-bromo-1-(4-fluorophenyl)-2-(methylthio)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-bromo-1-(4-fluorophenyl)-2-methylsulfanyl-4-oxoquinoline-3-carboxylate Traditional Name: 7-bromo-1-(4-fluorophenyl)-4-keto-2-(methylthio)quinoline-3-carboxylic acid ethyl ester Formula: C19H15BrFNO3S MolecularWeight: 436.294703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C(C1=O)C=CC(=C2)Br)C3=CC=C(C=C3)F)SC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C(C1=O)C=CC(=C2)Br)C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C19H15BrFNO3S/c1-3-25-19(24)16-17(23)14-9-4-11(20)10-15(14)22(18(16)26-2)13-7-5-12(21)6-8-13/h4-10H,3H2,1-2H3