4-[5-(5-ethanoyl-2-propoxy-phenyl)-3-ethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-1-yl]-2-methyl-butanoate

Systemtic Name: 4-[5-(5-ethanoyl-2-propoxy-phenyl)-3-ethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-1-yl]-2-methyl-butanoate Openeye Name: 4-[5-(5-acetyl-2-propoxy-phenyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-1-yl]-2-methyl-butanoate CAS Name: 4-[5-(5-acetyl-2-propoxyphenyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-1-yl]-2-methylbutanoate IUPAC Name: 4-[5-(5-acetyl-2-propoxyphenyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-1-yl]-2-methylbutanoate Traditional Name: 4-[5-(5-acetyl-2-propoxy-phenyl)-3-ethyl-7-keto-4H-pyrazolo[4,3-d]pyrimidin-1-yl]-2-methyl-butyrate Formula: C23H27N4O5- MolecularWeight: 439.48428

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)C)C2=NC(=O)C3=C(N2)C(=NN3CCC(C)C(=O)[O-])CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)C)C2=NC(=O)C3=C(N2)C(=NN3CCC(C)C(=O)[O-])CC

InChI

InChI=1S/C23H28N4O5/c1-5-11-32-18-8-7-15(14(4)28)12-16(18)21-24-19-17(6-2)26-27(20(19)22(29)25-21)10-9-13(3)23(30)31/h7-8,12-13H,5-6,9-11H2,1-4H3,(H,30,31)(H,24,25,29)/p-1