5-(4-fluorophenyl)-4-oxidanylidene-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid

Systemtic Name: 5-(4-fluorophenyl)-4-oxidanylidene-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid Openeye Name: 5-(4-fluorophenyl)-4-oxo-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid CAS Name: 5-(4-fluorophenyl)-4-oxo-7-(1-piperazinyl)-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid IUPAC Name: 5-(4-fluorophenyl)-4-oxo-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid Traditional Name: 5-(4-fluorophenyl)-4-keto-7-piperazino-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid Formula: C21H18FN3O3S MolecularWeight: 411.449323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC3=C(C(=C2)C4=CC=C(C=C4)F)C(=O)C(=C5N3CS5)C(=O)O

Isomeric SMILES

C1CN(CCN1)C2=CC3=C(C(=C2)C4=CC=C(C=C4)F)C(=O)C(=C5N3CS5)C(=O)O

InChI

InChI=1S/C21H18FN3O3S/c22-13-3-1-12(2-4-13)15-9-14(24-7-5-23-6-8-24)10-16-17(15)19(26)18(21(27)28)20-25(16)11-29-20/h1-4,9-10,23H,5-8,11H2,(H,27,28)