2-(4-tert-butylphenyl)-4-[4-(furan-2-ylmethyl)piperazin-1-yl]-1H-benzimidazole

Systemtic Name: 2-(4-tert-butylphenyl)-4-[4-(furan-2-ylmethyl)piperazin-1-yl]-1H-benzimidazole Openeye Name: 2-(4-tert-butylphenyl)-4-[4-(2-furylmethyl)piperazin-1-yl]-1H-benzimidazole CAS Name: 2-(4-tert-butylphenyl)-4-[4-(2-furanylmethyl)-1-piperazinyl]-1H-benzimidazole IUPAC Name: 2-(4-tert-butylphenyl)-4-[4-(furan-2-ylmethyl)piperazin-1-yl]-1H-benzimidazole Traditional Name: 2-(4-tert-butylphenyl)-4-[4-(2-furfuryl)piperazino]-1H-benzimidazole Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CC5=CC=CO5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CC5=CC=CO5

InChI

InChI=1S/C26H30N4O/c1-26(2,3)20-11-9-19(10-12-20)25-27-22-7-4-8-23(24(22)28-25)30-15-13-29(14-16-30)18-21-6-5-17-31-21/h4-12,17H,13-16,18H2,1-3H3,(H,27,28)