4-azanyl-1-[5-(hydroxymethyl)-1,4-oxathian-2-yl]pyrimidin-2-one

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(SCC(O1)N2C=CC(=NC2=O)N)CO

Isomeric SMILES

C1C(SCC(O1)N2C=CC(=NC2=O)N)CO

InChI

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