5-[bis(methylsulfanyl)methylidene]-1,3-diazinane-2,4,6-trione; sodium

Systemtic Name: 5-[bis(methylsulfanyl)methylidene]-1,3-diazinane-2,4,6-trione; sodium Openeye Name: 5-[bis(methylsulfanyl)methylene]hexahydropyrimidine-2,4,6-trione; sodium CAS Name: 5-[bis(methylthio)methylidene]-1,3-diazinane-2,4,6-trione; sodium IUPAC Name: 5-[bis(methylsulfanyl)methylidene]-1,3-diazinane-2,4,6-trione; sodium Traditional Name: 5-[bis(methylthio)methylene]barbituric acid; sodium Formula: C7H8N2NaO3S2 MolecularWeight: 255.26979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=C1C(=O)NC(=O)NC1=O)SC.[Na]

Isomeric SMILES

CSC(=C1C(=O)NC(=O)NC1=O)SC.[Na]

InChI

InChI=1S/C7H8N2O3S2.Na/c1-13-6(14-2)3-4(10)8-7(12)9-5(3)11;/h1-2H3,(H2,8,9,10,11,12);