3-(2-cyclohexylethyl)-2,4-dimethyl-1,3-thiazol-3-ium bromide

Systemtic Name: 3-(2-cyclohexylethyl)-2,4-dimethyl-1,3-thiazol-3-ium bromide Openeye Name: 3-(2-cyclohexylethyl)-2,4-dimethyl-thiazol-3-ium bromide CAS Name: 3-(2-cyclohexylethyl)-2,4-dimethylthiazol-3-ium bromide IUPAC Name: 3-(2-cyclohexylethyl)-2,4-dimethyl-1,3-thiazol-3-ium bromide Traditional Name: 3-(2-cyclohexylethyl)-2,4-dimethyl-thiazol-3-ium bromide Formula: C13H22BrNS MolecularWeight: 304.28948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=[N+]1CCC2CCCCC2)C.[Br-]

Isomeric SMILES

CC1=CSC(=[N+]1CCC2CCCCC2)C.[Br-]

InChI

InChI=1S/C13H22NS.BrH/c1-11-10-15-12(2)14(11)9-8-13-6-4-3-5-7-13;/h10,13H,3-9H2,1-2H3;1H/q+1;/p-1