2-[(2-oxidanylcyclopentyl)oxymethyl]-5-[6-[(phenylmethyl)amino]purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-[(2-oxidanylcyclopentyl)oxymethyl]-5-[6-[(phenylmethyl)amino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[6-(benzylamino)purin-9-yl]-5-[(2-hydroxycyclopentoxy)methyl]tetrahydrofuran-3,4-diol CAS Name: 2-[(2-hydroxycyclopentyl)oxymethyl]-5-[6-[(phenylmethyl)amino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-[6-(benzylamino)purin-9-yl]-5-[(2-hydroxycyclopentyl)oxymethyl]oxolane-3,4-diol Traditional Name: 2-[6-(benzylamino)purin-9-yl]-5-[(2-hydroxycyclopentoxy)methyl]tetrahydrofuran-3,4-diol Formula: C22H27N5O5 MolecularWeight: 441.48028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4NCC5=CC=CC=C5)O)O)O

Isomeric SMILES

C1CC(C(C1)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4NCC5=CC=CC=C5)O)O)O

InChI

InChI=1S/C22H27N5O5/c28-14-7-4-8-15(14)31-10-16-18(29)19(30)22(32-16)27-12-26-17-20(24-11-25-21(17)27)23-9-13-5-2-1-3-6-13/h1-3,5-6,11-12,14-16,18-19,22,28-30H,4,7-10H2,(H,23,24,25)