4-oxidanylidene-2-(4-piperidin-4-ylpiperidin-1-yl)-1-(1,3-thiazol-2-ylmethyl)quinoline-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-2-(4-piperidin-4-ylpiperidin-1-yl)-1-(1,3-thiazol-2-ylmethyl)quinoline-3-carboxylic acid Openeye Name: 4-oxo-2-[4-(4-piperidyl)-1-piperidyl]-1-(thiazol-2-ylmethyl)quinoline-3-carboxylic acid CAS Name: 4-oxo-2-[4-(4-piperidinyl)-1-piperidinyl]-1-(2-thiazolylmethyl)-3-quinolinecarboxylic acid IUPAC Name: 4-oxo-2-(4-piperidin-4-ylpiperidin-1-yl)-1-(1,3-thiazol-2-ylmethyl)quinoline-3-carboxylic acid Traditional Name: 4-keto-2-[4-(4-piperidyl)piperidino]-1-(thiazol-2-ylmethyl)quinoline-3-carboxylic acid Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2CCN(CC2)C3=C(C(=O)C4=CC=CC=C4N3CC5=NC=CS5)C(=O)O

Isomeric SMILES

C1CNCCC1C2CCN(CC2)C3=C(C(=O)C4=CC=CC=C4N3CC5=NC=CS5)C(=O)O

InChI

InChI=1S/C24H28N4O3S/c29-22-18-3-1-2-4-19(18)28(15-20-26-11-14-32-20)23(21(22)24(30)31)27-12-7-17(8-13-27)16-5-9-25-10-6-16/h1-4,11,14,16-17,25H,5-10,12-13,15H2,(H,30,31)