ethyl 4-oxidanylidene-4-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butanoate Openeye Name: ethyl 4-oxo-4-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butanoate CAS Name: 4-oxo-4-[4-(1-phenyl-6-propyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[4-(1-phenyl-6-propylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butanoate Traditional Name: 4-keto-4-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]butyric acid ethyl ester Formula: C24H30N6O3 MolecularWeight: 450.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)C(=O)CCC(=O)OCC

Isomeric SMILES

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)C(=O)CCC(=O)OCC

InChI

InChI=1S/C24H30N6O3/c1-3-8-20-26-23(19-17-25-30(24(19)27-20)18-9-6-5-7-10-18)29-15-13-28(14-16-29)21(31)11-12-22(32)33-4-2/h5-7,9-10,17H,3-4,8,11-16H2,1-2H3