N-[[2-(diethylaminomethylsulfanyl)-3-methyl-imidazol-3-ium-1-yl]methyl]-N-ethyl-ethanamine

Systemtic Name: N-[[2-(diethylaminomethylsulfanyl)-3-methyl-imidazol-3-ium-1-yl]methyl]-N-ethyl-ethanamine Openeye Name: N-[[2-(diethylaminomethylsulfanyl)-3-methyl-imidazol-3-ium-1-yl]methyl]-N-ethyl-ethanamine CAS Name: N-[[2-(diethylaminomethylthio)-3-methyl-1-imidazol-3-iumyl]methyl]-N-ethylethanamine IUPAC Name: N-[[2-(diethylaminomethylsulfanyl)-3-methylimidazol-3-ium-1-yl]methyl]-N-ethylethanamine Traditional Name: [[1-(diethylaminomethyl)-3-methyl-imidazol-3-ium-2-yl]thio]methyl-diethyl-amine Formula: C14H29N4S+ MolecularWeight: 285.47186

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CN1C=C[N+](=C1SCN(CC)CC)C

Isomeric SMILES

CCN(CC)CN1C=C[N+](=C1SCN(CC)CC)C

InChI

InChI=1S/C14H29N4S/c1-6-16(7-2)12-18-11-10-15(5)14(18)19-13-17(8-3)9-4/h10-11H,6-9,12-13H2,1-5H3/q+1