4-azanyl-1-[(2R,3R,4R,5R)-5-(hydroxymethyl)-3-nitrososulfanyl-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(2R,3R,4R,5R)-5-(hydroxymethyl)-3-nitrososulfanyl-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-nitrososulfanyl-tetrahydrofuran-2-yl]pyrimidin-2-one CAS Name: (2R,3R,4R,5R)-2-(4-amino-2-oxo-1-pyrimidinyl)-4-hydroxy-5-(hydroxymethyl)-N-oxo-3-oxolanesulfenamide IUPAC Name: 4-amino-1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-nitrososulfanyloxolan-2-yl]pyrimidin-2-one Traditional Name: 4-amino-1-[(2R,3R,4R,5R)-4-hydroxy-5-methylol-3-(nitrosothio)tetrahydrofuran-2-yl]pyrimidin-2-one Formula: C9H12N4O5S MolecularWeight: 288.28038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)SN=O

Isomeric SMILES

C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)SN=O

InChI

InChI=1S/C9H12N4O5S/c10-5-1-2-13(9(16)11-5)8-7(19-12-17)6(15)4(3-14)18-8/h1-2,4,6-8,14-15H,3H2,(H2,10,11,16)/t4-,6-,7-,8-/m1/s1