2-[4-[[2-ethyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[2-ethyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[2-ethyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[2-ethyl-6-(1-methyl-2-benzimidazolyl)-1-benzimidazolyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[2-ethyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[2-ethyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzonitrile Formula: C31H25N5 MolecularWeight: 467.5637

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C=C(C=C2)C5=NC6=CC=CC=C6N5C

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C=C(C=C2)C5=NC6=CC=CC=C6N5C

InChI

InChI=1S/C31H25N5/c1-3-30-33-27-17-16-23(31-34-26-10-6-7-11-28(26)35(31)2)18-29(27)36(30)20-21-12-14-22(15-13-21)25-9-5-4-8-24(25)19-32/h4-18H,3,20H2,1-2H3