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

Systemtic Name: propan-2-yl (4R)-4-[3-(4-butoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isopropyl (4R)-4-[3-(4-butoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-[3-(4-butoxy-3-methylphenyl)-1-phenyl-4-pyrazolyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (4R)-4-[3-(4-butoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-[3-(4-butoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isopropyl ester Formula: C29H34N4O4 MolecularWeight: 502.60466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=O)N3)C)C(=O)OC(C)C)C4=CC=CC=C4)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2=NN(C=C2[C@@H]3C(=C(NC(=O)N3)C)C(=O)OC(C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C29H34N4O4/c1-6-7-15-36-24-14-13-21(16-19(24)4)26-23(17-33(32-26)22-11-9-8-10-12-22)27-25(28(34)37-18(2)3)20(5)30-29(35)31-27/h8-14,16-18,27H,6-7,15H2,1-5H3,(H2,30,31,35)/t27-/m1/s1