4-[3-(phenylmethyl)imidazo[4,5-b]pyridin-2-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-[3-(phenylmethyl)imidazo[4,5-b]pyridin-2-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 4-(3-benzylimidazo[4,5-b]pyridin-2-yl)-1-[4-(2-pyridyl)piperazin-1-yl]butan-1-one CAS Name: 4-[3-(phenylmethyl)-2-imidazo[4,5-b]pyridinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(3-benzylimidazo[4,5-b]pyridin-2-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 4-(3-benzylimidazo[4,5-b]pyridin-2-yl)-1-[4-(2-pyridyl)piperazino]butan-1-one Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCC3=NC4=C(N3CC5=CC=CC=C5)N=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCC3=NC4=C(N3CC5=CC=CC=C5)N=CC=C4

InChI

InChI=1S/C26H28N6O/c33-25(31-18-16-30(17-19-31)23-11-4-5-14-27-23)13-6-12-24-29-22-10-7-15-28-26(22)32(24)20-21-8-2-1-3-9-21/h1-5,7-11,14-15H,6,12-13,16-20H2