1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[2-piperidin-1-ylethyl(thiophen-2-ylcarbonyl)amino]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[2-piperidin-1-ylethyl(thiophen-2-ylcarbonyl)amino]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[2-(1-piperidyl)ethyl-(thiophene-2-carbonyl)amino]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[[oxo(thiophen-2-yl)methyl]-[2-(1-piperidinyl)ethyl]amino]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[2-piperidin-1-ylethyl(thiophene-2-carbonyl)amino]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[2-piperidinoethyl(2-thenoyl)amino]quinoline-3-carboxylic acid Formula: C25H26FN3O4S MolecularWeight: 483.555043

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C(=O)C5=CC=CS5

Isomeric SMILES

C1CCN(CC1)CCN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C(=O)C5=CC=CS5

InChI

InChI=1S/C25H26FN3O4S/c26-19-13-17-20(29(16-6-7-16)15-18(23(17)30)25(32)33)14-21(19)28(24(31)22-5-4-12-34-22)11-10-27-8-2-1-3-9-27/h4-5,12-16H,1-3,6-11H2,(H,32,33)