3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C16H22N6O MolecularWeight: 314.38548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C(=NN1)C)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H22N6O/c1-12-14(13(2)20-19-12)4-5-15(23)21-8-10-22(11-9-21)16-17-6-3-7-18-16/h3,6-7H,4-5,8-11H2,1-2H3,(H,19,20)