4-butan-2-ylsulfanyl-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-butan-2-ylsulfanyl-1-thiophen-2-yl-butan-1-one Openeye Name: 4-sec-butylsulfanyl-1-(2-thienyl)butan-1-one CAS Name: 4-(butan-2-ylthio)-1-thiophen-2-yl-1-butanone IUPAC Name: 4-butan-2-ylsulfanyl-1-thiophen-2-ylbutan-1-one Traditional Name: 4-(sec-butylthio)-1-(2-thienyl)butan-1-one Formula: C12H18OS2 MolecularWeight: 242.40072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCCCC(=O)C1=CC=CS1

Isomeric SMILES

CCC(C)SCCCC(=O)C1=CC=CS1

InChI

InChI=1S/C12H18OS2/c1-3-10(2)14-8-4-6-11(13)12-7-5-9-15-12/h5,7,9-10H,3-4,6,8H2,1-2H3