2,2-dimethyl-5-[methylsulfanyl(thiophen-2-ylmethylsulfanyl)methylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[methylsulfanyl(thiophen-2-ylmethylsulfanyl)methylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[methylsulfanyl(2-thienylmethylsulfanyl)methylene]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[(methylthio)-(thiophen-2-ylmethylthio)methylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[methylsulfanyl(thiophen-2-ylmethylsulfanyl)methylidene]-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[(methylthio)-(2-thenylthio)methylene]-1,3-dioxane-4,6-quinone Formula: C13H14O4S3 MolecularWeight: 330.44286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=C(SC)SCC2=CC=CS2)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=C(SC)SCC2=CC=CS2)C(=O)O1)C

InChI

InChI=1S/C13H14O4S3/c1-13(2)16-10(14)9(11(15)17-13)12(18-3)20-7-8-5-4-6-19-8/h4-6H,7H2,1-3H3