ethyl 5-(1-ethyl-3-methyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)-3-methyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(1-ethyl-3-methyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)-3-methyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(1-ethyl-3-methyl-7-oxo-pyrazolo[4,3-d]pyrimidin-6-yl)-3-methyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(1-ethyl-3-methyl-7-oxo-6-pyrazolo[4,3-d]pyrimidinyl)-3-methyl-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1-ethyl-3-methyl-7-oxopyrazolo[4,3-d]pyrimidin-6-yl)-3-methyl-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(1-ethyl-7-keto-3-methyl-pyrazolo[4,3-d]pyrimidin-6-yl)-3-methyl-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=N1)C)N=CN(C2=O)C3=C(C(=NN3C4=CC=CC=C4)C)C(=O)OCC

Isomeric SMILES

CCN1C2=C(C(=N1)C)N=CN(C2=O)C3=C(C(=NN3C4=CC=CC=C4)C)C(=O)OCC

InChI

InChI=1S/C21H22N6O3/c1-5-26-18-17(14(4)23-26)22-12-25(20(18)28)19-16(21(29)30-6-2)13(3)24-27(19)15-10-8-7-9-11-15/h7-12H,5-6H2,1-4H3