2-[4-[4-(phenylmethyl)piperazin-1-yl]pyridin-3-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[4-(phenylmethyl)piperazin-1-yl]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-(4-benzylpiperazin-1-yl)-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[4-(phenylmethyl)-1-piperazinyl]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-(4-benzylpiperazin-1-yl)pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-(4-benzylpiperazino)-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C24H24N6O MolecularWeight: 412.48696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=NC=C3)C4=NC5=C(C=CC=C5N4)C(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=NC=C3)C4=NC5=C(C=CC=C5N4)C(=O)N

InChI

InChI=1S/C24H24N6O/c25-23(31)18-7-4-8-20-22(18)28-24(27-20)19-15-26-10-9-21(19)30-13-11-29(12-14-30)16-17-5-2-1-3-6-17/h1-10,15H,11-14,16H2,(H2,25,31)(H,27,28)