(E)-1-[(1R,2R)-2-methyl-1-oxidanylidene-1,3-dithian-2-yl]but-2-en-1-one

Systemtic Name: (E)-1-[(1R,2R)-2-methyl-1-oxidanylidene-1,3-dithian-2-yl]but-2-en-1-one Openeye Name: (E)-1-[(1R,2R)-2-methyl-1-oxo-1,3-dithian-2-yl]but-2-en-1-one CAS Name: (E)-1-[(1R,2R)-2-methyl-1-oxo-1,3-dithian-2-yl]-2-buten-1-one IUPAC Name: (E)-1-[(1R,2R)-2-methyl-1-oxo-1,3-dithian-2-yl]but-2-en-1-one Traditional Name: (E)-1-[(1R,2R)-1-keto-2-methyl-1,3-dithian-2-yl]but-2-en-1-one Formula: C9H14O2S2 MolecularWeight: 218.33626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)C1(SCCCS1=O)C

Isomeric SMILES

C/C=C/C(=O)[C@@]1(SCCC[S@]1=O)C

InChI

InChI=1S/C9H14O2S2/c1-3-5-8(10)9(2)12-6-4-7-13(9)11/h3,5H,4,6-7H2,1-2H3/b5-3+/t9-,13-/m1/s1