N2,N5-bis(1H-benzimidazol-2-yl)-3a-phenyl-6a-pyridin-4-yl-1,6-dihydroimidazo[4,5-d]imidazole-2,5-diamine

Systemtic Name: N2,N5-bis(1H-benzimidazol-2-yl)-3a-phenyl-6a-pyridin-4-yl-1,6-dihydroimidazo[4,5-d]imidazole-2,5-diamine Openeye Name: N2,N5-bis(1H-benzimidazol-2-yl)-3a-phenyl-6a-(4-pyridyl)-1,6-dihydroimidazo[4,5-d]imidazole-2,5-diamine CAS Name: N2,N5-bis(1H-benzimidazol-2-yl)-3a-phenyl-6a-pyridin-4-yl-1,6-dihydroimidazo[4,5-d]imidazole-2,5-diamine IUPAC Name: 2-N,5-N-bis(1H-benzimidazol-2-yl)-3a-phenyl-6a-pyridin-4-yl-1,6-dihydroimidazo[4,5-d]imidazole-2,5-diamine Traditional Name: 1H-benzimidazol-2-yl-[5-(1H-benzimidazol-2-ylamino)-3a-phenyl-6a-(4-pyridyl)-1,6-dihydroimidaz[4,5-d]imidazol-2-yl]amine Formula: C29H23N11 MolecularWeight: 525.56662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C23C(NC(=N2)NC4=NC5=CC=CC=C5N4)(NC(=N3)NC6=NC7=CC=CC=C7N6)C8=CC=NC=C8

Isomeric SMILES

C1=CC=C(C=C1)C23C(NC(=N2)NC4=NC5=CC=CC=C5N4)(NC(=N3)NC6=NC7=CC=CC=C7N6)C8=CC=NC=C8

InChI

InChI=1S/C29H23N11/c1-2-8-18(9-3-1)28-29(19-14-16-30-17-15-19,39-26(37-28)35-24-31-20-10-4-5-11-21(20)32-24)40-27(38-28)36-25-33-22-12-6-7-13-23(22)34-25/h1-17H,(H3,31,32,35,37,39)(H3,33,34,36,38,40)