2-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-5-[6-(oxolan-3-ylamino)purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-5-[6-(oxolan-3-ylamino)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-5-[6-(tetrahydrofuran-3-ylamino)purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-5-[6-(3-oxolanylamino)-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-5-[6-(oxolan-3-ylamino)purin-9-yl]oxolane-3,4-diol Traditional Name: 2-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-5-[6-(tetrahydrofuran-3-ylamino)purin-9-yl]tetrahydrofuran-3,4-diol Formula: C22H24N6O5S MolecularWeight: 484.52816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5NC6CCOC6)O)O

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5NC6CCOC6)O)O

InChI

InChI=1S/C22H24N6O5S/c1-11-26-14-6-13(2-3-16(14)34-11)32-8-15-18(29)19(30)22(33-15)28-10-25-17-20(23-9-24-21(17)28)27-12-4-5-31-7-12/h2-3,6,9-10,12,15,18-19,22,29-30H,4-5,7-8H2,1H3,(H,23,24,27)