2-methylsulfanyl-1H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 2-methylsulfanyl-1H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 2-methylsulfanyl-1H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 2-(methylthio)-1H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 2-methylsulfanyl-1H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 2-(methylthio)-1H-pyrimido[4,5-d]pyrimidin-4-one Formula: C7H6N4OS MolecularWeight: 194.21374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C2=CN=CN=C2N1

Isomeric SMILES

CSC1=NC(=O)C2=CN=CN=C2N1

InChI

InChI=1S/C7H6N4OS/c1-13-7-10-5-4(6(12)11-7)2-8-3-9-5/h2-3H,1H3,(H,8,9,10,11,12)