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

Systemtic Name: 9-[(2R,4S,5R)-5-[bis(oxidanyl)phosphinothioyloxymethyl]-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[(2R,4S,5R)-5-(dihydroxyphosphinothioyloxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[(2R,4S,5R)-5-(dihydroxyphosphinothioyloxymethyl)-4-hydroxy-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[(2R,4S,5R)-5-(dihydroxyphosphinothioyloxymethyl)-4-hydroxyoxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[(2R,4S,5R)-5-(dihydroxythiophosphoryloxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C10H13N4O6PS MolecularWeight: 348.272181

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC=NC3=O)COP(=S)(O)O)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC3=O)COP(=S)(O)O)O

InChI

InChI=1S/C10H13N4O6PS/c15-5-1-7(20-6(5)2-19-21(17,18)22)14-4-13-8-9(14)11-3-12-10(8)16/h3-7,15H,1-2H2,(H,11,12,16)(H2,17,18,22)/t5-,6+,7+/m0/s1