ethyl (4R)-6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-keto-4-(4-methoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N5O6 MolecularWeight: 429.42652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=C(C=C2)OC)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N5O6/c1-5-31-19(26)16-15(10-24-12(3)18(25(28)29)11(2)23-24)21-20(27)22-17(16)13-6-8-14(30-4)9-7-13/h6-9,17H,5,10H2,1-4H3,(H2,21,22,27)/t17-/m1/s1