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

Systemtic Name: 2-[4-[2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[2-(4-benzylpiperazin-1-yl)ethoxy]-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[2-[4-(phenylmethyl)-1-piperazinyl]ethoxy]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[2-(4-benzylpiperazin-1-yl)ethoxy]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[2-(4-benzylpiperazino)ethoxy]-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C26H28N6O2 MolecularWeight: 456.53952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=C(C=NC=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCOC2=C(C=NC=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)CC5=CC=CC=C5

InChI

InChI=1S/C26H28N6O2/c27-25(33)20-7-4-8-22-24(20)30-26(29-22)21-17-28-10-9-23(21)34-16-15-31-11-13-32(14-12-31)18-19-5-2-1-3-6-19/h1-10,17H,11-16,18H2,(H2,27,33)(H,29,30)