6-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-7H-purine

Systemtic Name: 6-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-7H-purine Openeye Name: 6-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-7H-purine CAS Name: 6-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-7H-purine IUPAC Name: 6-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-7H-purine Traditional Name: 6-[4-(coumaran-5-ylmethyl)piperazino]-7H-purine Formula: C18H20N6O MolecularWeight: 336.391

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C18H20N6O/c1-2-15-14(3-8-25-15)9-13(1)10-23-4-6-24(7-5-23)18-16-17(20-11-19-16)21-12-22-18/h1-2,9,11-12H,3-8,10H2,(H,19,20,21,22)