ethyl (3E)-7-azanylidene-3-[(4-methylphenyl)hydrazinylidene]-2-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl (3E)-7-azanylidene-3-[(4-methylphenyl)hydrazinylidene]-2-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl (3E)-7-imino-2-oxo-3-(p-tolylhydrazono)-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: (3E)-7-imino-3-[(4-methylphenyl)hydrazinylidene]-2-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (3E)-7-imino-3-[(4-methylphenyl)hydrazinylidene]-2-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: (3E)-7-imino-2-keto-3-(p-tolylhydrazono)-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=NNC3=CC=C(C=C3)C)C(=O)NN2C1=N

Isomeric SMILES

CCOC(=O)C1=CN=C2/C(=N\NC3=CC=C(C=C3)C)/C(=O)NN2C1=N

InChI

InChI=1S/C16H16N6O3/c1-3-25-16(24)11-8-18-14-12(15(23)21-22(14)13(11)17)20-19-10-6-4-9(2)5-7-10/h4-8,17,19H,3H2,1-2H3,(H,21,23)/b17-13?,20-12+