2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-[(2-methylphenyl)methyl]pyrazol-3-olate

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-[(2-methylphenyl)methyl]pyrazol-3-olate Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-(o-tolylmethyl)pyrazol-3-olate CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)-5-methyl-4-[(2-methylphenyl)methyl]-3-pyrazololate IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-[(2-methylphenyl)methyl]pyrazol-3-olate Traditional Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-(2-methylbenzyl)pyrazol-3-olate Formula: C18H19N4O- MolecularWeight: 307.36966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2=C(N(N=C2C)C3=NC(=CC(=N3)C)C)[O-]

Isomeric SMILES

CC1=CC=CC=C1CC2=C(N(N=C2C)C3=NC(=CC(=N3)C)C)[O-]

InChI

InChI=1S/C18H20N4O/c1-11-7-5-6-8-15(11)10-16-14(4)21-22(17(16)23)18-19-12(2)9-13(3)20-18/h5-9,23H,10H2,1-4H3/p-1