1-[3-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxamide Openeye Name: 1-[3-(4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-3-(4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxamide Traditional Name: 1-[3-(4-keto-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]isonipecotamide Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CCN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CCN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4

InChI

InChI=1S/C20H22N6O3/c21-18(28)14-6-9-24(10-7-14)17(27)8-11-25-13-22-19-16(20(25)29)12-23-26(19)15-4-2-1-3-5-15/h1-5,12-14H,6-11H2,(H2,21,28)