2-butan-2-ylsulfanyl-1-(2,5-dimethylthiophen-3-yl)ethanone

Systemtic Name: 2-butan-2-ylsulfanyl-1-(2,5-dimethylthiophen-3-yl)ethanone Openeye Name: 1-(2,5-dimethyl-3-thienyl)-2-sec-butylsulfanyl-ethanone CAS Name: 2-(butan-2-ylthio)-1-(2,5-dimethyl-3-thiophenyl)ethanone IUPAC Name: 2-butan-2-ylsulfanyl-1-(2,5-dimethylthiophen-3-yl)ethanone Traditional Name: 1-(2,5-dimethyl-3-thienyl)-2-(sec-butylthio)ethanone Formula: C12H18OS2 MolecularWeight: 242.40072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC(=O)C1=C(SC(=C1)C)C

Isomeric SMILES

CCC(C)SCC(=O)C1=C(SC(=C1)C)C

InChI

InChI=1S/C12H18OS2/c1-5-8(2)14-7-12(13)11-6-9(3)15-10(11)4/h6,8H,5,7H2,1-4H3