2-[[2-(1H-benzimidazol-2-yl)-4-(phenylmethyl)piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-(1H-benzimidazol-2-yl)-4-(phenylmethyl)piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[2-(1H-benzimidazol-2-yl)-4-benzyl-piperazin-1-yl]methyl]benzonitrile CAS Name: 2-[[2-(1H-benzimidazol-2-yl)-4-(phenylmethyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 2-[[2-(1H-benzimidazol-2-yl)-4-benzylpiperazin-1-yl]methyl]benzonitrile Traditional Name: 2-[[2-(1H-benzimidazol-2-yl)-4-benzyl-piperazino]methyl]benzonitrile Formula: C26H25N5 MolecularWeight: 407.5102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)CC5=CC=CC=C5C#N

Isomeric SMILES

C1CN(C(CN1CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)CC5=CC=CC=C5C#N

InChI

InChI=1S/C26H25N5/c27-16-21-10-4-5-11-22(21)18-31-15-14-30(17-20-8-2-1-3-9-20)19-25(31)26-28-23-12-6-7-13-24(23)29-26/h1-13,25H,14-15,17-19H2,(H,28,29)