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

Systemtic Name: methyl 4-[5-(5-ethanoyl-2-propoxy-phenyl)-3-ethyl-7-oxidanylidene-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-1-yl]butanoate Openeye Name: methyl 4-[5-(5-acetyl-2-propoxy-phenyl)-3-ethyl-7-oxo-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-1-yl]butanoate CAS Name: 4-[5-(5-acetyl-2-propoxyphenyl)-3-ethyl-7-oxo-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-1-yl]butanoic acid methyl ester IUPAC Name: methyl 4-[5-(5-acetyl-2-propoxyphenyl)-3-ethyl-7-oxo-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-1-yl]butanoate Traditional Name: 4-[5-(5-acetyl-2-propoxy-phenyl)-3-ethyl-7-keto-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-1-yl]butyric acid methyl ester Formula: C23H30N4O5 MolecularWeight: 442.5081

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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(NN3CCCC(=O)OC)CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)C)C2=NC(=O)C3=C(N2)C(NN3CCCC(=O)OC)CC

InChI

InChI=1S/C23H30N4O5/c1-5-12-32-18-10-9-15(14(3)28)13-16(18)22-24-20-17(6-2)26-27(21(20)23(30)25-22)11-7-8-19(29)31-4/h9-10,13,17,26H,5-8,11-12H2,1-4H3,(H,24,25,30)