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

Systemtic Name: 2-[[2-(1H-benzimidazol-2-yl)-4-(4-dimethylaminophenyl)carbonyl-piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[2-(1H-benzimidazol-2-yl)-4-[4-(dimethylamino)benzoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 2-[[2-(1H-benzimidazol-2-yl)-4-[(4-dimethylaminophenyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 2-[[2-(1H-benzimidazol-2-yl)-4-[4-(dimethylamino)benzoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 2-[[2-(1H-benzimidazol-2-yl)-4-[4-(dimethylamino)benzoyl]piperazino]methyl]benzonitrile Formula: C28H28N6O MolecularWeight: 464.56152

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCN(C(C2)C3=NC4=CC=CC=C4N3)CC5=CC=CC=C5C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCN(C(C2)C3=NC4=CC=CC=C4N3)CC5=CC=CC=C5C#N

InChI

InChI=1S/C28H28N6O/c1-32(2)23-13-11-20(12-14-23)28(35)34-16-15-33(18-22-8-4-3-7-21(22)17-29)26(19-34)27-30-24-9-5-6-10-25(24)31-27/h3-14,26H,15-16,18-19H2,1-2H3,(H,30,31)