2-[4-[[methyl(2-methylpropyl)amino]methyl]phenyl]-6-(2-pyrazol-1-ylethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[[methyl(2-methylpropyl)amino]methyl]phenyl]-6-(2-pyrazol-1-ylethyl)-1H-pyrimidin-4-one Openeye Name: 2-[4-[[isobutyl(methyl)amino]methyl]phenyl]-6-(2-pyrazol-1-ylethyl)-1H-pyrimidin-4-one CAS Name: 2-[4-[[methyl(2-methylpropyl)amino]methyl]phenyl]-6-[2-(1-pyrazolyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[4-[[methyl(2-methylpropyl)amino]methyl]phenyl]-6-(2-pyrazol-1-ylethyl)-1H-pyrimidin-4-one Traditional Name: 2-[4-[[isobutyl(methyl)amino]methyl]phenyl]-6-(2-pyrazol-1-ylethyl)-1H-pyrimidin-4-one Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C)CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)CCN3C=CC=N3

Isomeric SMILES

CC(C)CN(C)CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)CCN3C=CC=N3

InChI

InChI=1S/C21H27N5O/c1-16(2)14-25(3)15-17-5-7-18(8-6-17)21-23-19(13-20(27)24-21)9-12-26-11-4-10-22-26/h4-8,10-11,13,16H,9,12,14-15H2,1-3H3,(H,23,24,27)