1-(2-chlorophenyl)-6-ethyl-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(2-chlorophenyl)-6-ethyl-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(2-chlorophenyl)-6-ethyl-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(2-chlorophenyl)-6-ethyl-3-methyl-4-(4-propylsulfonyl-1-piperazinyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(2-chlorophenyl)-6-ethyl-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-(2-chlorophenyl)-6-ethyl-3-methyl-4-(4-propylsulfonylpiperazino)pyrazolo[3,4-d]pyrimidine Formula: C21H27ClN6O2S MolecularWeight: 462.99608

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC3=C2C(=NN3C4=CC=CC=C4Cl)C)CC

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC3=C2C(=NN3C4=CC=CC=C4Cl)C)CC

InChI

InChI=1S/C21H27ClN6O2S/c1-4-14-31(29,30)27-12-10-26(11-13-27)20-19-15(3)25-28(17-9-7-6-8-16(17)22)21(19)24-18(5-2)23-20/h6-9H,4-5,10-14H2,1-3H3