6-tert-butyl-2-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-1H-benzimidazole

Systemtic Name: 6-tert-butyl-2-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-1H-benzimidazole Openeye Name: 6-tert-butyl-2-[4-[3-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-1H-benzimidazole CAS Name: 6-tert-butyl-2-[4-[3-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-1H-benzimidazole IUPAC Name: 6-tert-butyl-2-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-1H-benzimidazole Traditional Name: 6-tert-butyl-2-[4-[3-(trifluoromethyl)-2-pyridyl]piperazino]-1H-benzimidazole Formula: C21H24F3N5 MolecularWeight: 403.44397

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)N=C(N2)N3CCN(CC3)C4=C(C=CC=N4)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N=C(N2)N3CCN(CC3)C4=C(C=CC=N4)C(F)(F)F

InChI

InChI=1S/C21H24F3N5/c1-20(2,3)14-6-7-16-17(13-14)27-19(26-16)29-11-9-28(10-12-29)18-15(21(22,23)24)5-4-8-25-18/h4-8,13H,9-12H2,1-3H3,(H,26,27)