3-methyl-1-phenyl-4-(4-propan-2-ylsulfonylpiperazin-1-yl)-6-propyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 3-methyl-1-phenyl-4-(4-propan-2-ylsulfonylpiperazin-1-yl)-6-propyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(4-isopropylsulfonylpiperazin-1-yl)-3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine CAS Name: 3-methyl-1-phenyl-4-(4-propan-2-ylsulfonyl-1-piperazinyl)-6-propylpyrazolo[3,4-d]pyrimidine IUPAC Name: 3-methyl-1-phenyl-4-(4-propan-2-ylsulfonylpiperazin-1-yl)-6-propylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(4-isopropylsulfonylpiperazino)-3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine Formula: C22H30N6O2S MolecularWeight: 442.5776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=N1)N4CCN(CC4)S(=O)(=O)C(C)C

Isomeric SMILES

CCCC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=N1)N4CCN(CC4)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H30N6O2S/c1-5-9-19-23-21(26-12-14-27(15-13-26)31(29,30)16(2)3)20-17(4)25-28(22(20)24-19)18-10-7-6-8-11-18/h6-8,10-11,16H,5,9,12-15H2,1-4H3