1-cyclopropyl-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-N-(1,3-thiazol-2-yl)quinoline-3-carboxamide

Systemtic Name: 1-cyclopropyl-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-N-(1,3-thiazol-2-yl)quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-N-thiazol-2-yl-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-1-cyclopropyl-6-fluoro-4-oxo-N-(2-thiazolyl)-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-N-(1,3-thiazol-2-yl)quinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-cyclopropyl-6-fluoro-4-keto-N-thiazol-2-yl-quinoline-3-carboxamide Formula: C22H22FN5O3S MolecularWeight: 455.505183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)NC4=NC=CS4)C5CC5)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)NC4=NC=CS4)C5CC5)F

InChI

InChI=1S/C22H22FN5O3S/c1-13(29)26-5-7-27(8-6-26)19-11-18-15(10-17(19)23)20(30)16(12-28(18)14-2-3-14)21(31)25-22-24-4-9-32-22/h4,9-12,14H,2-3,5-8H2,1H3,(H,24,25,31)