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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CN(N=C2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CN(N=C2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C

InChI

InChI=1S/C23H21N5O5/c1-3-33-22(29)19-14(2)24-23(30)25-21(19)18-13-27(16-9-5-4-6-10-16)26-20(18)15-8-7-11-17(12-15)28(31)32/h4-13,21H,3H2,1-2H3,(H2,24,25,30)