4-[2-[(2-methylpropan-2-yl)oxy]-1-methylsulfanyl-2-oxidanylidene-ethylidene]-1,3-dithietane-2-carboxylic acid

Systemtic Name: 4-[2-[(2-methylpropan-2-yl)oxy]-1-methylsulfanyl-2-oxidanylidene-ethylidene]-1,3-dithietane-2-carboxylic acid Openeye Name: 4-(2-tert-butoxy-1-methylsulfanyl-2-oxo-ethylidene)-1,3-dithietane-2-carboxylic acid CAS Name: 4-[2-[(2-methylpropan-2-yl)oxy]-1-(methylthio)-2-oxoethylidene]-1,3-dithietane-2-carboxylic acid IUPAC Name: 4-[2-[(2-methylpropan-2-yl)oxy]-1-methylsulfanyl-2-oxoethylidene]-1,3-dithietane-2-carboxylic acid Traditional Name: 4-[2-tert-butoxy-2-keto-1-(methylthio)ethylidene]-1,3-dithietane-2-carboxylic acid Formula: C10H14O4S3 MolecularWeight: 294.41076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=C1SC(S1)C(=O)O)SC

Isomeric SMILES

CC(C)(C)OC(=O)C(=C1SC(S1)C(=O)O)SC

InChI

InChI=1S/C10H14O4S3/c1-10(2,3)14-7(13)5(15-4)8-16-9(17-8)6(11)12/h9H,1-4H3,(H,11,12)