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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=C(N2)C=C(C=C3)C(C)(C)C)OCCCN4CCN(CC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=C(N2)C=C(C=C3)C(C)(C)C)OCCCN4CCN(CC4)C

InChI

InChI=1S/C26H36N4O/c1-19-17-20(25-27-22-9-8-21(26(2,3)4)18-23(22)28-25)7-10-24(19)31-16-6-11-30-14-12-29(5)13-15-30/h7-10,17-18H,6,11-16H2,1-5H3,(H,27,28)