1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)quinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-keto-7-(4-methylpiperazino)quinoline-3-carboxamide Formula: C22H27FN6O2S MolecularWeight: 458.552183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NC4=NN=C(S4)C(C)C

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NC4=NN=C(S4)C(C)C

InChI

InChI=1S/C22H27FN6O2S/c1-5-28-12-15(20(31)24-22-26-25-21(32-22)13(2)3)19(30)14-10-16(23)18(11-17(14)28)29-8-6-27(4)7-9-29/h10-13H,5-9H2,1-4H3,(H,24,26,31)