2-[6-azanyl-2-(2-oxidanylcyclohexyl)sulfanyl-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-(2-oxidanylcyclohexyl)sulfanyl-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-(2-hydroxycyclohexyl)sulfanyl-purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[(2-hydroxycyclohexyl)thio]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(2-hydroxycyclohexyl)sulfanylpurin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[(2-hydroxycyclohexyl)thio]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C16H23N5O5S MolecularWeight: 397.44932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)O)SC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1CCC(C(C1)O)SC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C16H23N5O5S/c17-13-10-14(20-16(19-13)27-9-4-2-1-3-7(9)23)21(6-18-10)15-12(25)11(24)8(5-22)26-15/h6-9,11-12,15,22-25H,1-5H2,(H2,17,19,20)