9-[(2S,3R,4S,5R)-5-(hydroxymethyl)-2-methylsulfanyl-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 9-[(2S,3R,4S,5R)-5-(hydroxymethyl)-2-methylsulfanyl-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-methylsulfanyl-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-(methylthio)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-methylsulfanyloxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[(2S,3R,4S,5R)-3,4-dihydroxy-5-methylol-2-(methylthio)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C11H14N4O5S MolecularWeight: 314.31766

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Descriptors Computed from Structure

Canonical SMILES:

CSC1(C(C(C(O1)CO)O)O)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

CS[C@@]1([C@@H]([C@@H]([C@H](O1)CO)O)O)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C11H14N4O5S/c1-21-11(8(18)7(17)5(2-16)20-11)15-4-14-6-9(15)12-3-13-10(6)19/h3-5,7-8,16-18H,2H2,1H3,(H,12,13,19)/t5-,7-,8-,11+/m1/s1