4-[4-(2-methylpropyl)piperazin-1-yl]-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(2-methylpropyl)piperazin-1-yl]-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(4-isobutylpiperazin-1-yl)-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(2-methylpropyl)-1-piperazinyl]-1-phenyl-6-propylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(2-methylpropyl)piperazin-1-yl]-1-phenyl-6-propylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(4-isobutylpiperazino)-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine Formula: C22H30N6 MolecularWeight: 378.5138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N6/c1-4-8-20-24-21(27-13-11-26(12-14-27)16-17(2)3)19-15-23-28(22(19)25-20)18-9-6-5-7-10-18/h5-7,9-10,15,17H,4,8,11-14,16H2,1-3H3