4-[[5-[[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[(3-benzyl-2-imino-benzimidazol-1-yl)methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[2-imino-3-(phenylmethyl)-1-benzimidazolyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[(3-benzyl-2-iminobenzimidazol-1-yl)methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[(3-benzyl-2-imino-benzimidazol-1-yl)methyl]imidazol-1-yl]methyl]benzonitrile Formula: C26H22N6 MolecularWeight: 418.49308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC4=CN=CN4CC5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC4=CN=CN4CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H22N6/c27-14-20-10-12-22(13-11-20)16-30-19-29-15-23(30)18-32-25-9-5-4-8-24(25)31(26(32)28)17-21-6-2-1-3-7-21/h1-13,15,19,28H,16-18H2