ethyl 2-[5-(5-ethanoyl-2-propoxy-phenyl)-3-ethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-2-yl]propanoate

Systemtic Name: ethyl 2-[5-(5-ethanoyl-2-propoxy-phenyl)-3-ethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-2-yl]propanoate Openeye Name: ethyl 2-[5-(5-acetyl-2-propoxy-phenyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-2-yl]propanoate CAS Name: 2-[5-(5-acetyl-2-propoxyphenyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-2-yl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[5-(5-acetyl-2-propoxyphenyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-2-yl]propanoate Traditional Name: 2-[5-(5-acetyl-2-propoxy-phenyl)-3-ethyl-7-keto-4H-pyrazolo[4,3-d]pyrimidin-2-yl]propionic acid ethyl ester Formula: C23H28N4O5 MolecularWeight: 440.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)C)C2=NC(=O)C3=NN(C(=C3N2)CC)C(C)C(=O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)C)C2=NC(=O)C3=NN(C(=C3N2)CC)C(C)C(=O)OCC

InChI

InChI=1S/C23H28N4O5/c1-6-11-32-18-10-9-15(14(5)28)12-16(18)21-24-19-17(7-2)27(13(4)23(30)31-8-3)26-20(19)22(29)25-21/h9-10,12-13H,6-8,11H2,1-5H3,(H,24,25,29)