1-methyl-5-[2-[4-(3-methylbutyl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-methyl-5-[2-[4-(3-methylbutyl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-(4-isopentylpiperazin-1-yl)-2-oxo-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-methyl-5-[2-[4-(3-methylbutyl)-1-piperazinyl]-2-oxoethyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-methyl-5-[2-[4-(3-methylbutyl)piperazin-1-yl]-2-oxoethyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-(4-isoamylpiperazino)-2-keto-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H26N6O2 MolecularWeight: 346.42734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC(C)CCN1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C17H26N6O2/c1-13(2)4-5-21-6-8-22(9-7-21)15(24)11-23-12-18-16-14(17(23)25)10-19-20(16)3/h10,12-13H,4-9,11H2,1-3H3