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

Systemtic Name: 4-azanyl-1-[(2R,5R)-5-(hydroxymethyl)-4-oxidanyl-thiolan-2-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrothiophen-2-yl]pyrimidin-2-one CAS Name: 4-amino-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)-2-thiolanyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidin-2-one Traditional Name: 4-amino-1-[(2R,5R)-4-hydroxy-5-methylol-tetrahydrothiophen-2-yl]pyrimidin-2-one Formula: C9H13N3O3S MolecularWeight: 243.28282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(SC1N2C=CC(=NC2=O)N)CO)O

Isomeric SMILES

C1[C@@H](S[C@@H](C1O)CO)N2C=CC(=NC2=O)N

InChI

InChI=1S/C9H13N3O3S/c10-7-1-2-12(9(15)11-7)8-3-5(14)6(4-13)16-8/h1-2,5-6,8,13-14H,3-4H2,(H2,10,11,15)/t5?,6-,8-/m1/s1