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

Systemtic Name: 6-(methoxymethyl)-1-(4-methoxyphenyl)-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Openeye Name: 6-(methoxymethyl)-1-(4-methoxyphenyl)-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine CAS Name: 6-(methoxymethyl)-1-(4-methoxyphenyl)-4-(4-propylsulfonyl-1-piperazinyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-(methoxymethyl)-1-(4-methoxyphenyl)-4-(4-propylsulfonylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine Traditional Name: 6-(methoxymethyl)-1-(4-methoxyphenyl)-4-(4-propylsulfonylpiperazino)pyrazolo[3,4-d]pyrimidine Formula: C21H28N6O4S MolecularWeight: 460.54982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N6O4S/c1-4-13-32(28,29)26-11-9-25(10-12-26)20-18-14-22-27(16-5-7-17(31-3)8-6-16)21(18)24-19(23-20)15-30-2/h5-8,14H,4,9-13,15H2,1-3H3