(2S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)-N-propoxy-oxolane-2-carboxamide

Systemtic Name: (2S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)-N-propoxy-oxolane-2-carboxamide Openeye Name: (2S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-propoxy-tetrahydrofuran-2-carboxamide CAS Name: (2S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-propoxy-2-oxolanecarboxamide IUPAC Name: (2S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-propoxyoxolane-2-carboxamide Traditional Name: (2S,4S,5R)-5-adenin-9-yl-3,4-dihydroxy-N-propoxy-tetrahydrofuran-2-carboxamide Formula: C13H18N6O5 MolecularWeight: 338.31922

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Descriptors Computed from Structure

Canonical SMILES:

CCCONC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O

Isomeric SMILES

CCCONC(=O)[C@@H]1C([C@@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O

InChI

InChI=1S/C13H18N6O5/c1-2-3-23-18-12(22)9-7(20)8(21)13(24-9)19-5-17-6-10(14)15-4-16-11(6)19/h4-5,7-9,13,20-21H,2-3H2,1H3,(H,18,22)(H2,14,15,16)/t7?,8-,9-,13+/m0/s1