1-tert-butyl-5-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-tert-butyl-5-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-tert-butyl-5-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-tert-butyl-5-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-tert-butyl-5-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-tert-butyl-5-[3-keto-3-(4-phenylpiperazino)propyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)N1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H28N6O2/c1-22(2,3)28-20-18(15-24-28)21(30)27(16-23-20)10-9-19(29)26-13-11-25(12-14-26)17-7-5-4-6-8-17/h4-8,15-16H,9-14H2,1-3H3