1-(3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl)ethanone

Systemtic Name: 1-(3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl)ethanone Openeye Name: 1-(3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl)ethanone CAS Name: 1-(3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl)ethanone IUPAC Name: 1-(3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl)ethanone Traditional Name: 1-(3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl)ethanone Formula: C13H16OS2 MolecularWeight: 252.39554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)SCC(CS2)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)SCC(CS2)(C)C

InChI

InChI=1S/C13H16OS2/c1-9(14)10-4-5-11-12(6-10)16-8-13(2,3)7-15-11/h4-6H,7-8H2,1-3H3