2-(4,6-dimethylpyrimidin-2-yl)-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-4H-pyrazol-3-one

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-4H-pyrazol-3-one Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-[2-oxo-2-(1-piperidyl)ethyl]-4H-pyrazol-3-one CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)-5-[2-oxo-2-(1-piperidinyl)ethyl]-4H-pyrazol-3-one IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-(2-oxo-2-piperidin-1-ylethyl)-4H-pyrazol-3-one Traditional Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-(2-keto-2-piperidino-ethyl)-2-pyrazolin-3-one Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=O)CC(=N2)CC(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=O)CC(=N2)CC(=O)N3CCCCC3)C

InChI

InChI=1S/C16H21N5O2/c1-11-8-12(2)18-16(17-11)21-15(23)10-13(19-21)9-14(22)20-6-4-3-5-7-20/h8H,3-7,9-10H2,1-2H3