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

Systemtic Name: 6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Openeye Name: 6-(methoxymethyl)-3-methyl-4-(4-propylsulfonylpiperazin-1-yl)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine CAS Name: 6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-4-(4-propylsulfonyl-1-piperazinyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Traditional Name: 6-(methoxymethyl)-3-methyl-4-(4-propylsulfonylpiperazino)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine Formula: C22H30N6O3S MolecularWeight: 458.577

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N6O3S/c1-5-14-32(29,30)27-12-10-26(11-13-27)21-20-17(3)25-28(18-8-6-16(2)7-9-18)22(20)24-19(23-21)15-31-4/h6-9H,5,10-15H2,1-4H3