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

Systemtic Name: 2-[2-[2-[4-(phenylmethyl)piperazin-1-yl]ethylamino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[2-[2-(4-benzylpiperazin-1-yl)ethylamino]-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[2-[2-[4-(phenylmethyl)-1-piperazinyl]ethylamino]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[2-[2-(4-benzylpiperazin-1-yl)ethylamino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[2-[2-(4-benzylpiperazino)ethylamino]-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C26H29N7O MolecularWeight: 455.55476

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC2=C(C=CC=N2)C3=NC4=C(C=CC=C4N3)C(=O)N)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCNC2=C(C=CC=N2)C3=NC4=C(C=CC=C4N3)C(=O)N)CC5=CC=CC=C5

InChI

InChI=1S/C26H29N7O/c27-24(34)20-8-4-10-22-23(20)31-26(30-22)21-9-5-11-28-25(21)29-12-13-32-14-16-33(17-15-32)18-19-6-2-1-3-7-19/h1-11H,12-18H2,(H2,27,34)(H,28,29)(H,30,31)