2,2-dimethyl-1-(3-phenyl-4-pyrimidin-4-yl-pyrazol-1-yl)propan-1-one

Systemtic Name: 2,2-dimethyl-1-(3-phenyl-4-pyrimidin-4-yl-pyrazol-1-yl)propan-1-one Openeye Name: 2,2-dimethyl-1-(3-phenyl-4-pyrimidin-4-yl-pyrazol-1-yl)propan-1-one CAS Name: 2,2-dimethyl-1-[3-phenyl-4-(4-pyrimidinyl)-1-pyrazolyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-(3-phenyl-4-pyrimidin-4-ylpyrazol-1-yl)propan-1-one Traditional Name: 2,2-dimethyl-1-[3-phenyl-4-(4-pyrimidyl)pyrazol-1-yl]propan-1-one Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1C=C(C(=N1)C2=CC=CC=C2)C3=NC=NC=C3

Isomeric SMILES

CC(C)(C)C(=O)N1C=C(C(=N1)C2=CC=CC=C2)C3=NC=NC=C3

InChI

InChI=1S/C18H18N4O/c1-18(2,3)17(23)22-11-14(15-9-10-19-12-20-15)16(21-22)13-7-5-4-6-8-13/h4-12H,1-3H3