5-methyl-2-(phenylmethylsulfanyl)-4,5-dihydro-1H-imidazol-3-ium chloride

Systemtic Name: 5-methyl-2-(phenylmethylsulfanyl)-4,5-dihydro-1H-imidazol-3-ium chloride Openeye Name: 2-benzylsulfanyl-5-methyl-4,5-dihydro-1H-imidazol-3-ium chloride CAS Name: 5-methyl-2-(phenylmethylthio)-4,5-dihydro-1H-imidazol-3-ium chloride IUPAC Name: 2-benzylsulfanyl-5-methyl-4,5-dihydro-1H-imidazol-3-ium chloride Traditional Name: 2-(benzylthio)-4-methyl-2-imidazolin-1-ium chloride Formula: C11H15ClN2S MolecularWeight: 242.7682

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+]=C(N1)SCC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC1C[NH+]=C(N1)SCC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C11H14N2S.ClH/c1-9-7-12-11(13-9)14-8-10-5-3-2-4-6-10;/h2-6,9H,7-8H2,1H3,(H,12,13);1H