2-[[4,7-bis[(1-methylbenzimidazol-2-yl)methyl]-1,4,7-triazonan-1-yl]methyl]-1-methyl-benzimidazole

Systemtic Name: 2-[[4,7-bis[(1-methylbenzimidazol-2-yl)methyl]-1,4,7-triazonan-1-yl]methyl]-1-methyl-benzimidazole Openeye Name: 2-[[4,7-bis[(1-methylbenzimidazol-2-yl)methyl]-1,4,7-triazonan-1-yl]methyl]-1-methyl-benzimidazole CAS Name: 2-[[4,7-bis[(1-methyl-2-benzimidazolyl)methyl]-1,4,7-triazonan-1-yl]methyl]-1-methylbenzimidazole IUPAC Name: 2-[[4,7-bis[(1-methylbenzimidazol-2-yl)methyl]-1,4,7-triazonan-1-yl]methyl]-1-methylbenzimidazole Traditional Name: 2-[[4,7-bis[(1-methylbenzimidazol-2-yl)methyl]-1,4,7-triazonan-1-yl]methyl]-1-methyl-benzimidazole Formula: C33H39N9 MolecularWeight: 561.72306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CN3CCN(CCN(CC3)CC4=NC5=CC=CC=C5N4C)CC6=NC7=CC=CC=C7N6C

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CN3CCN(CCN(CC3)CC4=NC5=CC=CC=C5N4C)CC6=NC7=CC=CC=C7N6C

InChI

InChI=1S/C33H39N9/c1-37-28-13-7-4-10-25(28)34-31(37)22-40-16-18-41(23-32-35-26-11-5-8-14-29(26)38(32)2)20-21-42(19-17-40)24-33-36-27-12-6-9-15-30(27)39(33)3/h4-15H,16-24H2,1-3H3