2-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-[4-(2-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-[[1-butyl-5-(trifluoromethyl)-2-benzimidazolyl]thio]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-1-[4-(2-pyridyl)piperazino]ethanone Formula: C23H26F3N5OS MolecularWeight: 477.54565

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C(F)(F)F)N=C1SCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C(F)(F)F)N=C1SCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H26F3N5OS/c1-2-3-10-31-19-8-7-17(23(24,25)26)15-18(19)28-22(31)33-16-21(32)30-13-11-29(12-14-30)20-6-4-5-9-27-20/h4-9,15H,2-3,10-14,16H2,1H3