5-[3-(4-ethanoylpiperazin-1-yl)-3-oxidanylidene-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[3-(4-ethanoylpiperazin-1-yl)-3-oxidanylidene-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[3-(4-acetylpiperazin-1-yl)-3-oxo-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[3-(4-acetyl-1-piperazinyl)-3-oxopropyl]-6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[3-(4-acetylpiperazino)-3-keto-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H24N6O3 MolecularWeight: 408.45366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C21H24N6O3/c1-15-23-20-18(14-22-27(20)17-6-4-3-5-7-17)21(30)26(15)9-8-19(29)25-12-10-24(11-13-25)16(2)28/h3-7,14H,8-13H2,1-2H3