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

Systemtic Name: (2S,3S,4R,5R)-5-(6-chloranylpurin-9-yl)-N,2-dimethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: (2S,3S,4R,5R)-5-(6-chloropurin-9-yl)-3,4-dihydroxy-N,2-dimethyl-tetrahydrofuran-2-carboxamide CAS Name: (2S,3S,4R,5R)-5-(6-chloro-9-purinyl)-3,4-dihydroxy-N,2-dimethyl-2-oxolanecarboxamide IUPAC Name: (2S,3S,4R,5R)-5-(6-chloropurin-9-yl)-3,4-dihydroxy-N,2-dimethyloxolane-2-carboxamide Traditional Name: (2S,3S,4R,5R)-5-(6-chloropurin-9-yl)-3,4-dihydroxy-N,2-dimethyl-tetrahydrofuran-2-carboxamide Formula: C12H14ClN5O4 MolecularWeight: 327.72366

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(O1)N2C=NC3=C2N=CN=C3Cl)O)O)C(=O)NC

Isomeric SMILES

C[C@]1([C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3Cl)O)O)C(=O)NC

InChI

InChI=1S/C12H14ClN5O4/c1-12(11(21)14-2)7(20)6(19)10(22-12)18-4-17-5-8(13)15-3-16-9(5)18/h3-4,6-7,10,19-20H,1-2H3,(H,14,21)/t6-,7+,10-,12+/m1/s1