S-(2-tert-butylsulfanyl-3-methyl-pentyl) ethanethioate

Systemtic Name: S-(2-tert-butylsulfanyl-3-methyl-pentyl) ethanethioate Openeye Name: S-(2-tert-butylsulfanyl-3-methyl-pentyl) ethanethioate CAS Name: ethanethioic acid S-[2-(tert-butylthio)-3-methylpentyl] ester IUPAC Name: S-(2-tert-butylsulfanyl-3-methylpentyl) ethanethioate Traditional Name: ethanethioic acid S-[2-(tert-butylthio)-3-methyl-pentyl] ester Formula: C12H24OS2 MolecularWeight: 248.44836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CSC(=O)C)SC(C)(C)C

Isomeric SMILES

CCC(C)C(CSC(=O)C)SC(C)(C)C

InChI

InChI=1S/C12H24OS2/c1-7-9(2)11(8-14-10(3)13)15-12(4,5)6/h9,11H,7-8H2,1-6H3