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

Systemtic Name: 3-methyl-4-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 3-methyl-4-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine CAS Name: 3-methyl-4-(4-methylsulfonyl-1-piperazinyl)-1-phenyl-6-propylpyrazolo[3,4-d]pyrimidine IUPAC Name: 3-methyl-4-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-6-propylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(4-mesylpiperazino)-3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidine Formula: C20H26N6O2S MolecularWeight: 414.52444

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N6O2S/c1-4-8-17-21-19(24-11-13-25(14-12-24)29(3,27)28)18-15(2)23-26(20(18)22-17)16-9-6-5-7-10-16/h5-7,9-10H,4,8,11-14H2,1-3H3