methyl 3,4-dimethyl-6-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3,4-dimethyl-6-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3,4-dimethyl-6-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-6-[3-(3-nitrophenyl)-1-phenyl-4-pyrazolyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3,4-dimethyl-6-[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3,4-dimethyl-6-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C23H21N5O5 MolecularWeight: 447.44334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=CN(N=C2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1C)C2=CN(N=C2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C23H21N5O5/c1-14-19(22(29)33-3)21(24-23(30)26(14)2)18-13-27(16-9-5-4-6-10-16)25-20(18)15-8-7-11-17(12-15)28(31)32/h4-13,21H,1-3H3,(H,24,30)