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

Systemtic Name: 4-[[5-azanyl-2-[[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-amino-2-[(3-benzyl-2-imino-benzimidazol-1-yl)methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-amino-2-[[2-imino-3-(phenylmethyl)-1-benzimidazolyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-amino-2-[(3-benzyl-2-iminobenzimidazol-1-yl)methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-amino-2-[(3-benzyl-2-imino-benzimidazol-1-yl)methyl]imidazol-1-yl]methyl]benzonitrile Formula: C26H23N7 MolecularWeight: 433.50772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC4=NC=C(N4CC5=CC=C(C=C5)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC4=NC=C(N4CC5=CC=C(C=C5)C#N)N

InChI

InChI=1S/C26H23N7/c27-14-19-10-12-21(13-11-19)17-33-24(28)15-30-25(33)18-32-23-9-5-4-8-22(23)31(26(32)29)16-20-6-2-1-3-7-20/h1-13,15,29H,16-18,28H2