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

Systemtic Name: 4-[3-(3-methylbutyl)imidazo[4,5-b]pyridin-2-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 4-(3-isopentylimidazo[4,5-b]pyridin-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 4-[3-(3-methylbutyl)-2-imidazo[4,5-b]pyridinyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-[3-(3-methylbutyl)imidazo[4,5-b]pyridin-2-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 4-(3-isoamylimidazo[4,5-b]pyridin-2-yl)-1-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C23H31N7O MolecularWeight: 421.53854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=NC2=C1N=CC=C2)CCCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(C)CCN1C(=NC2=C1N=CC=C2)CCCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H31N7O/c1-18(2)9-13-30-20(27-19-6-4-10-24-22(19)30)7-3-8-21(31)28-14-16-29(17-15-28)23-25-11-5-12-26-23/h4-6,10-12,18H,3,7-9,13-17H2,1-2H3