5-bromanyl-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)thiolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 5-bromanyl-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)thiolan-2-yl]pyrimidine-2,4-dione Openeye Name: 5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrothiophen-2-yl]pyrimidine-2,4-dione CAS Name: 5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)-2-thiolanyl]pyrimidine-2,4-dione IUPAC Name: 5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidine-2,4-dione Traditional Name: 5-bromo-1-(3,4-dihydroxy-5-methylol-tetrahydrothiophen-2-yl)pyrimidine-2,4-quinone Formula: C9H11BrN2O5S MolecularWeight: 339.16304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=O)N1C2C(C(C(S2)CO)O)O)Br

Isomeric SMILES

C1=C(C(=O)NC(=O)N1C2C(C(C(S2)CO)O)O)Br

InChI

InChI=1S/C9H11BrN2O5S/c10-3-1-12(9(17)11-7(3)16)8-6(15)5(14)4(2-13)18-8/h1,4-6,8,13-15H,2H2,(H,11,16,17)