9-[[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-3H-purine-6-thione

Systemtic Name: 9-[[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-3H-purine-6-thione Openeye Name: 9-[[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]methyl]-3H-purine-6-thione CAS Name: 9-[[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]methyl]-3H-purine-6-thione IUPAC Name: 9-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl]-3H-purine-6-thione Traditional Name: 9-[(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)methyl]-3H-purine-6-thione Formula: C11H14N4O4S MolecularWeight: 298.31826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=S)C2=C(N1)N(C=N2)CC3C(C(C(O3)CO)O)O

Isomeric SMILES

C1=NC(=S)C2=C(N1)N(C=N2)CC3C(C(C(O3)CO)O)O

InChI

InChI=1S/C11H14N4O4S/c16-2-6-9(18)8(17)5(19-6)1-15-4-14-7-10(15)12-3-13-11(7)20/h3-6,8-9,16-18H,1-2H2,(H,12,13,20)