6-[[4-[1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]carbonylpiperazin-1-yl]methyl]-2-tert-butyl-1H-pyrimidin-4-one

Systemtic Name: 6-[[4-[1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]carbonylpiperazin-1-yl]methyl]-2-tert-butyl-1H-pyrimidin-4-one Openeye Name: 6-[[4-[1-[(2-amino-4-pyridyl)methyl]piperidine-4-carbonyl]piperazin-1-yl]methyl]-2-tert-butyl-1H-pyrimidin-4-one CAS Name: 6-[[4-[[1-[(2-amino-4-pyridinyl)methyl]-4-piperidinyl]-oxomethyl]-1-piperazinyl]methyl]-2-tert-butyl-1H-pyrimidin-4-one IUPAC Name: 6-[[4-[1-[(2-aminopyridin-4-yl)methyl]piperidine-4-carbonyl]piperazin-1-yl]methyl]-2-tert-butyl-1H-pyrimidin-4-one Traditional Name: 6-[[4-[1-[(2-amino-4-pyridyl)methyl]isonipecotoyl]piperazino]methyl]-2-tert-butyl-1H-pyrimidin-4-one Formula: C25H37N7O2 MolecularWeight: 467.60698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=O)C=C(N1)CN2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC(=NC=C4)N

Isomeric SMILES

CC(C)(C)C1=NC(=O)C=C(N1)CN2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC(=NC=C4)N

InChI

InChI=1S/C25H37N7O2/c1-25(2,3)24-28-20(15-22(33)29-24)17-31-10-12-32(13-11-31)23(34)19-5-8-30(9-6-19)16-18-4-7-27-21(26)14-18/h4,7,14-15,19H,5-6,8-13,16-17H2,1-3H3,(H2,26,27)(H,28,29,33)