2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-2-imidazolin-1-ium Formula: C12H17N2S+ MolecularWeight: 221.34178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=[NH+]CCN2

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=[NH+]CCN2

InChI

InChI=1S/C12H16N2S/c1-9-3-4-10(2)11(7-9)8-15-12-13-5-6-14-12/h3-4,7H,5-6,8H2,1-2H3,(H,13,14)/p+1