2-[2-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]-6-piperidin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]-6-piperidin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[2-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]-6-(4-piperidyl)-1H-pyrimidin-4-one CAS Name: 2-[2-[[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]methyl]phenyl]-6-(4-piperidinyl)-1H-pyrimidin-4-one IUPAC Name: 2-[2-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]-6-piperidin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[2-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]-6-(4-piperidyl)-1H-pyrimidin-4-one Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)CC2=CC=CC=C2C3=NC(=O)C=C(N3)C4CCNCC4

Isomeric SMILES

CN1C=C(C=N1)CN(C)CC2=CC=CC=C2C3=NC(=O)C=C(N3)C4CCNCC4

InChI

InChI=1S/C22H28N6O/c1-27(13-16-12-24-28(2)14-16)15-18-5-3-4-6-19(18)22-25-20(11-21(29)26-22)17-7-9-23-10-8-17/h3-6,11-12,14,17,23H,7-10,13,15H2,1-2H3,(H,25,26,29)