4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[4-(3-chlorophenyl)sulfonylpiperazino]-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C21H19ClN6O2S MolecularWeight: 454.93256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)S(=O)(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)S(=O)(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C21H19ClN6O2S/c22-16-5-4-8-18(13-16)31(29,30)27-11-9-26(10-12-27)20-19-14-25-28(21(19)24-15-23-20)17-6-2-1-3-7-17/h1-8,13-15H,9-12H2