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

Systemtic Name: (phenylmethyl) 6-methyl-4-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: benzyl 6-methyl-2-oxo-4-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-methyl-4-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-methyl-4-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid benzyl ester Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C3C(=C(NC(=O)N3)C)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C3C(=C(NC(=O)N3)C)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N4O3/c1-19-13-15-22(16-14-19)26-24(17-33(32-26)23-11-7-4-8-12-23)27-25(20(2)30-29(35)31-27)28(34)36-18-21-9-5-3-6-10-21/h3-17,27H,18H2,1-2H3,(H2,30,31,35)