6-(2-azanylethyl)-2-[4-[[methyl(3-pyrazol-1-ylpropyl)amino]methyl]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 6-(2-azanylethyl)-2-[4-[[methyl(3-pyrazol-1-ylpropyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Openeye Name: 6-(2-aminoethyl)-2-[4-[[methyl(3-pyrazol-1-ylpropyl)amino]methyl]phenyl]-1H-pyrimidin-4-one CAS Name: 6-(2-aminoethyl)-2-[4-[[methyl-[3-(1-pyrazolyl)propyl]amino]methyl]phenyl]-1H-pyrimidin-4-one IUPAC Name: 6-(2-aminoethyl)-2-[4-[[methyl(3-pyrazol-1-ylpropyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Traditional Name: 6-(2-aminoethyl)-2-[4-[[methyl(3-pyrazol-1-ylpropyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Formula: C20H26N6O MolecularWeight: 366.46004

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1C=CC=N1)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)CCN

Isomeric SMILES

CN(CCCN1C=CC=N1)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)CCN

InChI

InChI=1S/C20H26N6O/c1-25(11-3-13-26-12-2-10-22-26)15-16-4-6-17(7-5-16)20-23-18(8-9-21)14-19(27)24-20/h2,4-7,10,12,14H,3,8-9,11,13,15,21H2,1H3,(H,23,24,27)