4-[(6-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]-1H-pyrimidin-6-one

Systemtic Name: 4-[(6-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]-1H-pyrimidin-6-one Openeye Name: 4-[(6-oxo-1H-pyrimidin-4-yl)sulfanyl]-1H-pyrimidin-6-one CAS Name: 4-[(6-oxo-1H-pyrimidin-4-yl)thio]-1H-pyrimidin-6-one IUPAC Name: 4-[(6-oxo-1H-pyrimidin-4-yl)sulfanyl]-1H-pyrimidin-6-one Traditional Name: 4-[(6-keto-1H-pyrimidin-4-yl)thio]-1H-pyrimidin-6-one Formula: C8H6N4O2S MolecularWeight: 222.22384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=CNC1=O)SC2=CC(=O)NC=N2

Isomeric SMILES

C1=C(N=CNC1=O)SC2=CC(=O)NC=N2

InChI

InChI=1S/C8H6N4O2S/c13-5-1-7(11-3-9-5)15-8-2-6(14)10-4-12-8/h1-4H,(H,9,11,13)(H,10,12,14)