6-(1H-indazol-4-yl)-1-methyl-4-[2-(4-methylsulfonylpiperazin-1-yl)ethoxy]pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-(1H-indazol-4-yl)-1-methyl-4-[2-(4-methylsulfonylpiperazin-1-yl)ethoxy]pyrazolo[3,4-d]pyrimidine Openeye Name: 6-(1H-indazol-4-yl)-1-methyl-4-[2-(4-methylsulfonylpiperazin-1-yl)ethoxy]pyrazolo[3,4-d]pyrimidine CAS Name: 6-(1H-indazol-4-yl)-1-methyl-4-[2-(4-methylsulfonyl-1-piperazinyl)ethoxy]pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-(1H-indazol-4-yl)-1-methyl-4-[2-(4-methylsulfonylpiperazin-1-yl)ethoxy]pyrazolo[3,4-d]pyrimidine Traditional Name: 6-(1H-indazol-4-yl)-4-[2-(4-mesylpiperazino)ethoxy]-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C20H24N8O3S MolecularWeight: 456.52136

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=NNC4=CC=C3)OCCN5CCN(CC5)S(=O)(=O)C

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=NNC4=CC=C3)OCCN5CCN(CC5)S(=O)(=O)C

InChI

InChI=1S/C20H24N8O3S/c1-26-19-16(13-22-26)20(31-11-10-27-6-8-28(9-7-27)32(2,29)30)24-18(23-19)14-4-3-5-17-15(14)12-21-25-17/h3-5,12-13H,6-11H2,1-2H3,(H,21,25)