7-[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-sulfanylidene-3H-purin-6-one

Systemtic Name: 7-[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-sulfanylidene-3H-purin-6-one Openeye Name: 7-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-thioxo-3H-purin-6-one CAS Name: 7-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-sulfanylidene-3H-purin-6-one IUPAC Name: 7-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-sulfanylidene-3H-purin-6-one Traditional Name: 7-[(2S,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-2-thioxo-3H-purin-6-one Formula: C10H12N4O4S MolecularWeight: 284.29168

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2C(=O)NC(=S)N3)CO)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@@H]1N2C=NC3=C2C(=O)NC(=S)N3)CO)O

InChI

InChI=1S/C10H12N4O4S/c15-2-5-4(16)1-6(18-5)14-3-11-8-7(14)9(17)13-10(19)12-8/h3-6,15-16H,1-2H2,(H2,12,13,17,19)/t4-,5+,6-/m0/s1