(2S,3S,4R,5R)-3-azanyl-N-methyl-5-[6-(methylamino)purin-9-yl]-4-oxidanyl-oxolane-2-carboxamide

Systemtic Name: (2S,3S,4R,5R)-3-azanyl-N-methyl-5-[6-(methylamino)purin-9-yl]-4-oxidanyl-oxolane-2-carboxamide Openeye Name: (2S,3S,4R,5R)-3-amino-4-hydroxy-N-methyl-5-[6-(methylamino)purin-9-yl]tetrahydrofuran-2-carboxamide CAS Name: (2S,3S,4R,5R)-3-amino-4-hydroxy-N-methyl-5-[6-(methylamino)-9-purinyl]-2-oxolanecarboxamide IUPAC Name: (2S,3S,4R,5R)-3-amino-4-hydroxy-N-methyl-5-[6-(methylamino)purin-9-yl]oxolane-2-carboxamide Traditional Name: (2S,3S,4R,5R)-3-amino-4-hydroxy-N-methyl-5-[6-(methylamino)purin-9-yl]tetrahydrofuran-2-carboxamide Formula: C12H17N7O3 MolecularWeight: 307.30848

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2C3C(C(C(O3)C(=O)NC)N)O

Isomeric SMILES

CNC1=NC=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)C(=O)NC)N)O

InChI

InChI=1S/C12H17N7O3/c1-14-9-6-10(17-3-16-9)19(4-18-6)12-7(20)5(13)8(22-12)11(21)15-2/h3-5,7-8,12,20H,13H2,1-2H3,(H,15,21)(H,14,16,17)/t5-,7+,8-,12+/m0/s1