(2S,3S,4R,5R)-N-ethyl-5-[6-(methylamino)-2-(1,2,3-triazol-1-yl)purin-9-yl]-3,4-bis(oxidanyl)oxolane-2-carboxamide

Systemtic Name: (2S,3S,4R,5R)-N-ethyl-5-[6-(methylamino)-2-(1,2,3-triazol-1-yl)purin-9-yl]-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: (2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-(methylamino)-2-(triazol-1-yl)purin-9-yl]tetrahydrofuran-2-carboxamide CAS Name: (2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-(methylamino)-2-(1-triazolyl)-9-purinyl]-2-oxolanecarboxamide IUPAC Name: (2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-(methylamino)-2-(triazol-1-yl)purin-9-yl]oxolane-2-carboxamide Traditional Name: (2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-(methylamino)-2-(triazol-1-yl)purin-9-yl]tetrahydrofuran-2-carboxamide Formula: C15H19N9O4 MolecularWeight: 389.36926

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3NC)N4C=CN=N4)O)O

Isomeric SMILES

CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=C(N=C3NC)N4C=CN=N4)O)O

InChI

InChI=1S/C15H19N9O4/c1-3-17-13(27)10-8(25)9(26)14(28-10)23-6-18-7-11(16-2)20-15(21-12(7)23)24-5-4-19-22-24/h4-6,8-10,14,25-26H,3H2,1-2H3,(H,17,27)(H,16,20,21)/t8-,9+,10-,14+/m0/s1