ethyl 6,7-bis(fluoranyl)-1-(4-methoxyphenyl)-2-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7-bis(fluoranyl)-1-(4-methoxyphenyl)-2-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6,7-difluoro-1-(4-methoxyphenyl)-2-methylsulfanyl-4-oxo-quinoline-3-carboxylate CAS Name: 6,7-difluoro-1-(4-methoxyphenyl)-2-(methylthio)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-difluoro-1-(4-methoxyphenyl)-2-methylsulfanyl-4-oxoquinoline-3-carboxylate Traditional Name: 6,7-difluoro-4-keto-1-(4-methoxyphenyl)-2-(methylthio)quinoline-3-carboxylic acid ethyl ester Formula: C20H17F2NO4S MolecularWeight: 405.415086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C2C1=O)F)F)C3=CC=C(C=C3)OC)SC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C2C1=O)F)F)C3=CC=C(C=C3)OC)SC

InChI

InChI=1S/C20H17F2NO4S/c1-4-27-20(25)17-18(24)13-9-14(21)15(22)10-16(13)23(19(17)28-3)11-5-7-12(26-2)8-6-11/h5-10H,4H2,1-3H3