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

Systemtic Name: 4-[(2-chlorophenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-1H-pyrazol-3-one Openeye Name: 4-[(2-chlorophenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-1H-pyrazol-3-one CAS Name: 4-[(2-chlorophenyl)methyl]-2-(4,6-dimethyl-2-pyrimidinyl)-5-methyl-1H-pyrazol-3-one IUPAC Name: 4-[(2-chlorophenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-1H-pyrazol-3-one Traditional Name: 4-(2-chlorobenzyl)-2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-3-pyrazolin-3-one Formula: C17H17ClN4O MolecularWeight: 328.79608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=O)C(=C(N2)C)CC3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=O)C(=C(N2)C)CC3=CC=CC=C3Cl)C

InChI

InChI=1S/C17H17ClN4O/c1-10-8-11(2)20-17(19-10)22-16(23)14(12(3)21-22)9-13-6-4-5-7-15(13)18/h4-8,21H,9H2,1-3H3