N-[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]sulfonyl-2-azanyl-ethanamide

Systemtic Name: N-[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]sulfonyl-2-azanyl-ethanamide Openeye Name: 2-amino-N-[2-(6-aminopurin-9-yl)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]sulfonyl-acetamide CAS Name: 2-amino-N-[[2-(6-aminopurin-9-yl)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]sulfonyl]acetamide IUPAC Name: 2-amino-N-[2-(6-aminopurin-9-yl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]sulfonylacetamide Traditional Name: N-(2-adenin-9-yl-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)sulfonyl-2-amino-acetamide Formula: C12H17N7O7S MolecularWeight: 403.37108

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3(C(C(C(O3)CO)O)O)S(=O)(=O)NC(=O)CN

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C3(C(C(C(O3)CO)O)O)S(=O)(=O)NC(=O)CN

InChI

InChI=1S/C12H17N7O7S/c13-1-6(21)18-27(24,25)12(9(23)8(22)5(2-20)26-12)19-4-17-7-10(14)15-3-16-11(7)19/h3-5,8-9,20,22-23H,1-2,13H2,(H,18,21)(H2,14,15,16)