methyl 4-[1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-pyrazol-4-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-pyrazol-4-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-[1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-pyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[1-(4,6-dimethyl-2-pyrimidinyl)-3-phenyl-4-pyrazolyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[1-(4,6-dimethylpyrimidin-2-yl)-3-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-pyrazol-4-yl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C22H22N6O3 MolecularWeight: 418.44848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=C(C(=N2)C3=CC=CC=C3)C4C(=C(NC(=O)N4)C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=C(C(=N2)C3=CC=CC=C3)C4C(=C(NC(=O)N4)C)C(=O)OC)C

InChI

InChI=1S/C22H22N6O3/c1-12-10-13(2)24-21(23-12)28-11-16(18(27-28)15-8-6-5-7-9-15)19-17(20(29)31-4)14(3)25-22(30)26-19/h5-11,19H,1-4H3,(H2,25,26,30)