4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-1-methylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-methylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[4-(coumaran-5-ylmethyl)piperazino]-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C19H22N6O MolecularWeight: 350.41758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C19H22N6O/c1-23-18-16(11-22-23)19(21-13-20-18)25-7-5-24(6-8-25)12-14-2-3-17-15(10-14)4-9-26-17/h2-3,10-11,13H,4-9,12H2,1H3