N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[2-(4-methylpiperazino)-5-(trifluoromethyl)phenyl]-2-(8-quinolylthio)acetamide Formula: C23H23F3N4OS MolecularWeight: 460.51513

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H23F3N4OS/c1-29-10-12-30(13-11-29)19-8-7-17(23(24,25)26)14-18(19)28-21(31)15-32-20-6-2-4-16-5-3-9-27-22(16)20/h2-9,14H,10-13,15H2,1H3,(H,28,31)