6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Openeye Name: 6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine CAS Name: 6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-4-(4-propylsulfonyl-1-piperazinyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Traditional Name: 6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-4-(4-propylsulfonylpiperazino)pyrazolo[3,4-d]pyrimidine Formula: C22H27FN6O2S MolecularWeight: 458.552183

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC3=C2C(=NN3C4=CC=C(C=C4)F)C)C5CC5

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC3=C2C(=NN3C4=CC=C(C=C4)F)C)C5CC5

InChI

InChI=1S/C22H27FN6O2S/c1-3-14-32(30,31)28-12-10-27(11-13-28)21-19-15(2)26-29(18-8-6-17(23)7-9-18)22(19)25-20(24-21)16-4-5-16/h6-9,16H,3-5,10-14H2,1-2H3