2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]-1-thiophen-2-yl-ethanone bromide

Systemtic Name: 2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]-1-thiophen-2-yl-ethanone bromide Openeye Name: 2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]-1-(2-thienyl)ethanone bromide CAS Name: 2-[(3-methyl-1H-imidazol-3-ium-2-yl)thio]-1-thiophen-2-ylethanone bromide IUPAC Name: 2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]-1-thiophen-2-ylethanone bromide Traditional Name: 2-[(3-methyl-1H-imidazol-3-ium-2-yl)thio]-1-(2-thienyl)ethanone bromide Formula: C10H11BrN2OS2 MolecularWeight: 319.24114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)SCC(=O)C2=CC=CS2.[Br-]

Isomeric SMILES

C[N+]1=C(NC=C1)SCC(=O)C2=CC=CS2.[Br-]

InChI

InChI=1S/C10H10N2OS2.BrH/c1-12-5-4-11-10(12)15-7-8(13)9-3-2-6-14-9;/h2-6H,7H2,1H3;1H