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

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[2-(4-ethylpiperazino)-5-(trifluoromethyl)phenyl]-2-(8-quinolylthio)acetamide Formula: C24H25F3N4OS MolecularWeight: 474.54171

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C24H25F3N4OS/c1-2-30-11-13-31(14-12-30)20-9-8-18(24(25,26)27)15-19(20)29-22(32)16-33-21-7-3-5-17-6-4-10-28-23(17)21/h3-10,15H,2,11-14,16H2,1H3,(H,29,32)