1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-N-(5-propyl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide

Systemtic Name: 1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-N-(5-propyl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-7-[4-(2-furoyl)piperazino]-4-keto-N-(5-propyl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide Formula: C26H27FN6O4S MolecularWeight: 538.593783

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCN(CC4)C(=O)C5=CC=CO5)CC

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCN(CC4)C(=O)C5=CC=CO5)CC

InChI

InChI=1S/C26H27FN6O4S/c1-3-6-22-29-30-26(38-22)28-24(35)17-15-31(4-2)19-14-20(18(27)13-16(19)23(17)34)32-8-10-33(11-9-32)25(36)21-7-5-12-37-21/h5,7,12-15H,3-4,6,8-11H2,1-2H3,(H,28,30,35)