ethyl 1-(ethyldisulfanyl)-6,8-bis(fluoranyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-(ethyldisulfanyl)-6,8-bis(fluoranyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(ethyldisulfanyl)-6,8-difluoro-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 1-(ethyldisulfanyl)-6,8-difluoro-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(ethyldisulfanyl)-6,8-difluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 1-(ethyldisulfanyl)-6,8-difluoro-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid ethyl ester Formula: C19H23F2N3O3S2 MolecularWeight: 443.531026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CCN(CC3)C)F)SSCC

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CCN(CC3)C)F)SSCC

InChI

InChI=1S/C19H23F2N3O3S2/c1-4-27-19(26)13-11-24(29-28-5-2)16-12(18(13)25)10-14(20)17(15(16)21)23-8-6-22(3)7-9-23/h10-11H,4-9H2,1-3H3