[3,4-diacetyloxy-5-(6-azanyl-8-methylperoxysulfanyl-purin-9-yl)oxolan-2-yl]methyl ethanoate

Systemtic Name: [3,4-diacetyloxy-5-(6-azanyl-8-methylperoxysulfanyl-purin-9-yl)oxolan-2-yl]methyl ethanoate Openeye Name: [3,4-diacetoxy-5-(6-amino-8-methylperoxysulfanyl-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3,4-diacetyloxy-5-[6-amino-8-(methyldioxythio)-9-purinyl]-2-oxolanyl]methyl ester IUPAC Name: [3,4-diacetyloxy-5-(6-amino-8-methylperoxysulfanylpurin-9-yl)oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3,4-diacetoxy-5-[6-amino-8-(methylperoxythio)purin-9-yl]tetrahydrofuran-2-yl]methyl ester Formula: C17H21N5O9S MolecularWeight: 471.44174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C3=C(C(=NC=N3)N)N=C2SOOC)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(O1)N2C3=C(C(=NC=N3)N)N=C2SOOC)OC(=O)C)OC(=O)C

InChI

InChI=1S/C17H21N5O9S/c1-7(23)27-5-10-12(28-8(2)24)13(29-9(3)25)16(30-10)22-15-11(14(18)19-6-20-15)21-17(22)32-31-26-4/h6,10,12-13,16H,5H2,1-4H3,(H2,18,19,20)