6-[3-oxidanylidene-3-[4-(phenylsulfonyl)piperazin-1-yl]propyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[3-oxidanylidene-3-[4-(phenylsulfonyl)piperazin-1-yl]propyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[3-[4-(benzenesulfonyl)piperazin-1-yl]-3-oxo-propyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[3-[4-(benzenesulfonyl)-1-piperazinyl]-3-oxopropyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[3-[4-(benzenesulfonyl)piperazin-1-yl]-3-oxopropyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[3-(4-besylpiperazino)-3-keto-propyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C24H24N6O4S MolecularWeight: 492.55016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H24N6O4S/c31-22(28-13-15-29(16-14-28)35(33,34)19-9-5-2-6-10-19)12-11-21-26-23-20(24(32)27-21)17-25-30(23)18-7-3-1-4-8-18/h1-10,17,25H,11-16H2