[(2S,5R)-5-(6-aminopurin-9-yl)-4-methylsulfonyl-2,5-dihydrofuran-2-yl]methyl ethanoate

Systemtic Name: [(2S,5R)-5-(6-aminopurin-9-yl)-4-methylsulfonyl-2,5-dihydrofuran-2-yl]methyl ethanoate Openeye Name: [(2S,5R)-5-(6-aminopurin-9-yl)-4-methylsulfonyl-2,5-dihydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2S,5R)-5-(6-aminopurin-9-yl)-4-methylsulfonyl-2,5-dihydrofuran-2-yl]methyl ester IUPAC Name: [(2S,5R)-5-(6-aminopurin-9-yl)-4-methylsulfonyl-2,5-dihydrofuran-2-yl]methyl acetate Traditional Name: acetic acid [(2S,5R)-5-adenin-9-yl-4-mesyl-2,5-dihydrofuran-2-yl]methyl ester Formula: C13H15N5O5S MolecularWeight: 353.3537

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C=C(C(O1)N2C=NC3=C2N=CN=C3N)S(=O)(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1C=C([C@@H](O1)N2C=NC3=C2N=CN=C3N)S(=O)(=O)C

InChI

InChI=1S/C13H15N5O5S/c1-7(19)22-4-8-3-9(24(2,20)21)13(23-8)18-6-17-10-11(14)15-5-16-12(10)18/h3,5-6,8,13H,4H2,1-2H3,(H2,14,15,16)/t8-,13+/m0/s1