1-methyl-5-methylsulfanyl-3,4-dihydro-2H-pyrrol-1-ium iodide

Systemtic Name: 1-methyl-5-methylsulfanyl-3,4-dihydro-2H-pyrrol-1-ium iodide Openeye Name: 1-methyl-5-methylsulfanyl-3,4-dihydro-2H-pyrrol-1-ium iodide CAS Name: 1-methyl-5-(methylthio)-3,4-dihydro-2H-pyrrol-1-ium iodide IUPAC Name: 1-methyl-5-methylsulfanyl-3,4-dihydro-2H-pyrrol-1-ium iodide Traditional Name: 1-methyl-2-(methylthio)-1-pyrrolin-1-ium iodide Formula: C6H12INS MolecularWeight: 257.13565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(CCC1)SC.[I-]

Isomeric SMILES

C[N+]1=C(CCC1)SC.[I-]

InChI

InChI=1S/C6H12NS.HI/c1-7-5-3-4-6(7)8-2;/h3-5H2,1-2H3;1H/q+1;/p-1