6-azanyl-2-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(2,4-dihydroxyphenyl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-(2,4-dihydroxyphenyl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-(2,4-dihydroxyphenyl)-2-keto-ethyl]thio]-1H-pyrimidin-4-one Formula: C12H11N3O4S MolecularWeight: 293.29844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)O)C(=O)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

C1=CC(=C(C=C1O)O)C(=O)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C12H11N3O4S/c13-10-4-11(19)15-12(14-10)20-5-9(18)7-2-1-6(16)3-8(7)17/h1-4,16-17H,5H2,(H3,13,14,15,19)