6-ethyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-ethyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 6-ethyl-1-phenyl-4-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidine CAS Name: 6-ethyl-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 6-ethyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-ethyl-1-phenyl-4-(4-tosylpiperazino)pyrazolo[3,4-d]pyrimidine Formula: C24H26N6O2S MolecularWeight: 462.56724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C24H26N6O2S/c1-3-22-26-23(21-17-25-30(24(21)27-22)19-7-5-4-6-8-19)28-13-15-29(16-14-28)33(31,32)20-11-9-18(2)10-12-20/h4-12,17H,3,13-16H2,1-2H3