7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-N-(3-piperidin-1-ylsulfonylphenyl)quinoline-3-carboxamide

Systemtic Name: 7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-N-(3-piperidin-1-ylsulfonylphenyl)quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-N-[3-(1-piperidylsulfonyl)phenyl]quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-1-ethyl-6-fluoro-4-oxo-N-[3-(1-piperidinylsulfonyl)phenyl]-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-N-(3-piperidin-1-ylsulfonylphenyl)quinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-ethyl-6-fluoro-4-keto-N-(3-piperidinosulfonylphenyl)quinoline-3-carboxamide Formula: C29H34FN5O5S MolecularWeight: 583.674163

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C29H34FN5O5S/c1-3-32-19-24(29(38)31-21-8-7-9-22(16-21)41(39,40)35-10-5-4-6-11-35)28(37)23-17-25(30)27(18-26(23)32)34-14-12-33(13-15-34)20(2)36/h7-9,16-19H,3-6,10-15H2,1-2H3,(H,31,38)