4-[4-[1-(phenylmethyl)benzimidazol-2-yl]piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-[1-(phenylmethyl)benzimidazol-2-yl]piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(1-benzylbenzimidazol-2-yl)piperazine-1-carbonyl]benzonitrile CAS Name: 4-[oxo-[4-[1-(phenylmethyl)-2-benzimidazolyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[4-(1-benzylbenzimidazol-2-yl)piperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-(1-benzylbenzimidazol-2-yl)piperazine-1-carbonyl]benzonitrile Formula: C26H23N5O MolecularWeight: 421.49372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3N2CC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3N2CC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H23N5O/c27-18-20-10-12-22(13-11-20)25(32)29-14-16-30(17-15-29)26-28-23-8-4-5-9-24(23)31(26)19-21-6-2-1-3-7-21/h1-13H,14-17,19H2