4-(1H-benzimidazol-2-yl)-N,N-bis[4-(1H-benzimidazol-2-yl)-2,5-dimethyl-phenyl]-2,5-dimethyl-aniline

Systemtic Name: 4-(1H-benzimidazol-2-yl)-N,N-bis[4-(1H-benzimidazol-2-yl)-2,5-dimethyl-phenyl]-2,5-dimethyl-aniline Openeye Name: 4-(1H-benzimidazol-2-yl)-N,N-bis[4-(1H-benzimidazol-2-yl)-2,5-dimethyl-phenyl]-2,5-dimethyl-aniline CAS Name: 4-(1H-benzimidazol-2-yl)-N,N-bis[4-(1H-benzimidazol-2-yl)-2,5-dimethylphenyl]-2,5-dimethylaniline IUPAC Name: 4-(1H-benzimidazol-2-yl)-N,N-bis[4-(1H-benzimidazol-2-yl)-2,5-dimethylphenyl]-2,5-dimethylaniline Traditional Name: tris[4-(1H-benzimidazol-2-yl)-2,5-dimethyl-phenyl]amine Formula: C45H39N7 MolecularWeight: 677.83806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NC3=CC=CC=C3N2)C)N(C4=C(C=C(C(=C4)C)C5=NC6=CC=CC=C6N5)C)C7=C(C=C(C(=C7)C)C8=NC9=CC=CC=C9N8)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NC3=CC=CC=C3N2)C)N(C4=C(C=C(C(=C4)C)C5=NC6=CC=CC=C6N5)C)C7=C(C=C(C(=C7)C)C8=NC9=CC=CC=C9N8)C

InChI

InChI=1S/C45H39N7/c1-25-22-40(28(4)19-31(25)43-46-34-13-7-8-14-35(34)47-43)52(41-23-26(2)32(20-29(41)5)44-48-36-15-9-10-16-37(36)49-44)42-24-27(3)33(21-30(42)6)45-50-38-17-11-12-18-39(38)51-45/h7-24H,1-6H3,(H,46,47)(H,48,49)(H,50,51)