6-tert-butyl-2-[4-[3-(4-methylpiperazin-1-yl)butoxy]phenyl]-1H-benzimidazole

Systemtic Name: 6-tert-butyl-2-[4-[3-(4-methylpiperazin-1-yl)butoxy]phenyl]-1H-benzimidazole Openeye Name: 6-tert-butyl-2-[4-[3-(4-methylpiperazin-1-yl)butoxy]phenyl]-1H-benzimidazole CAS Name: 6-tert-butyl-2-[4-[3-(4-methyl-1-piperazinyl)butoxy]phenyl]-1H-benzimidazole IUPAC Name: 6-tert-butyl-2-[4-[3-(4-methylpiperazin-1-yl)butoxy]phenyl]-1H-benzimidazole Traditional Name: 6-tert-butyl-2-[4-[3-(4-methylpiperazino)butoxy]phenyl]-1H-benzimidazole Formula: C26H36N4O MolecularWeight: 420.59024

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(C)(C)C)N4CCN(CC4)C

Isomeric SMILES

CC(CCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(C)(C)C)N4CCN(CC4)C

InChI

InChI=1S/C26H36N4O/c1-19(30-15-13-29(5)14-16-30)12-17-31-22-9-6-20(7-10-22)25-27-23-11-8-21(26(2,3)4)18-24(23)28-25/h6-11,18-19H,12-17H2,1-5H3,(H,27,28)