1-phenyl-4-(4-pyridin-3-ylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-phenyl-4-(4-pyridin-3-ylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-phenyl-4-[4-(3-pyridylsulfonyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidine CAS Name: 1-phenyl-4-[4-(3-pyridinylsulfonyl)-1-piperazinyl]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-phenyl-4-(4-pyridin-3-ylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-phenyl-4-[4-(3-pyridylsulfonyl)piperazino]pyrazolo[3,4-d]pyrimidine Formula: C20H19N7O2S MolecularWeight: 421.47556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N7O2S/c28-30(29,17-7-4-8-21-13-17)26-11-9-25(10-12-26)19-18-14-24-27(20(18)23-15-22-19)16-5-2-1-3-6-16/h1-8,13-15H,9-12H2