6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methylimidazol-3-ium-1-yl)methanone iodide

Systemtic Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methylimidazol-3-ium-1-yl)methanone iodide Openeye Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methylimidazol-3-ium-1-yl)methanone iodide CAS Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methyl-1-imidazol-3-iumyl)methanone iodide IUPAC Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methylimidazol-3-ium-1-yl)methanone iodide Traditional Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methylimidazol-3-ium-1-yl)methanone iodide Formula: C12H14IN3OS MolecularWeight: 375.22853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C(=O)N2CCC3=C(C2)C=CS3.[I-]

Isomeric SMILES

C[N+]1=CN(C=C1)C(=O)N2CCC3=C(C2)C=CS3.[I-]

InChI

InChI=1S/C12H14N3OS.HI/c1-13-5-6-15(9-13)12(16)14-4-2-11-10(8-14)3-7-17-11;/h3,5-7,9H,2,4,8H2,1H3;1H/q+1;/p-1