7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-N-methyl-4-oxidanylidene-N-(thiophen-2-ylmethyl)quinoline-3-carboxamide

Systemtic Name: 7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-N-methyl-4-oxidanylidene-N-(thiophen-2-ylmethyl)quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-N-methyl-4-oxo-N-(2-thienylmethyl)quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-1-ethyl-6-fluoro-N-methyl-4-oxo-N-(thiophen-2-ylmethyl)-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-N-methyl-4-oxo-N-(thiophen-2-ylmethyl)quinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-ethyl-6-fluoro-4-keto-N-methyl-N-(2-thenyl)quinoline-3-carboxamide Formula: C24H27FN4O3S MolecularWeight: 470.559583

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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)N(C)CC4=CC=CS4

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)N(C)CC4=CC=CS4

InChI

InChI=1S/C24H27FN4O3S/c1-4-27-15-19(24(32)26(3)14-17-6-5-11-33-17)23(31)18-12-20(25)22(13-21(18)27)29-9-7-28(8-10-29)16(2)30/h5-6,11-13,15H,4,7-10,14H2,1-3H3