2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)-5-methyl-4-phenethyl-1H-pyrazol-3-one IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one Traditional Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-phenethyl-3-pyrazolin-3-one Formula: C18H20N4O MolecularWeight: 308.3776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=O)C(=C(N2)C)CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=O)C(=C(N2)C)CCC3=CC=CC=C3)C

InChI

InChI=1S/C18H20N4O/c1-12-11-13(2)20-18(19-12)22-17(23)16(14(3)21-22)10-9-15-7-5-4-6-8-15/h4-8,11,21H,9-10H2,1-3H3