S-[[2-(butylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate

Systemtic Name: S-[[2-(butylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate Openeye Name: S-[[2-(butylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate CAS Name: 2-propenethioic acid S-[[2-[(butylthio)methyl]-1,3-dithiolan-4-yl]methyl] ester IUPAC Name: S-[[2-(butylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate Traditional Name: prop-2-enethioic acid S-[[2-[(butylthio)methyl]-1,3-dithiolan-4-yl]methyl] ester Formula: C12H20OS4 MolecularWeight: 308.5466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1SCC(S1)CSC(=O)C=C

Isomeric SMILES

CCCCSCC1SCC(S1)CSC(=O)C=C

InChI

InChI=1S/C12H20OS4/c1-3-5-6-14-9-12-16-8-10(17-12)7-15-11(13)4-2/h4,10,12H,2-3,5-9H2,1H3