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

Systemtic Name: (2S,3S,4R,5R)-3-azanyl-5-[2-chloranyl-6-(methylamino)purin-9-yl]-N-methyl-4-oxidanyl-oxolane-2-carboxamide Openeye Name: (2S,3S,4R,5R)-3-amino-5-[2-chloro-6-(methylamino)purin-9-yl]-4-hydroxy-N-methyl-tetrahydrofuran-2-carboxamide CAS Name: (2S,3S,4R,5R)-3-amino-5-[2-chloro-6-(methylamino)-9-purinyl]-4-hydroxy-N-methyl-2-oxolanecarboxamide IUPAC Name: (2S,3S,4R,5R)-3-amino-5-[2-chloro-6-(methylamino)purin-9-yl]-4-hydroxy-N-methyloxolane-2-carboxamide Traditional Name: (2S,3S,4R,5R)-3-amino-5-[2-chloro-6-(methylamino)purin-9-yl]-4-hydroxy-N-methyl-tetrahydrofuran-2-carboxamide Formula: C12H16ClN7O3 MolecularWeight: 341.75354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClN7O3/c1-15-8-5-9(19-12(13)18-8)20(3-17-5)11-6(21)4(14)7(23-11)10(22)16-2/h3-4,6-7,11,21H,14H2,1-2H3,(H,16,22)(H,15,18,19)/t4-,6+,7-,11+/m0/s1