4-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-3-methyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: 4-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-3-methyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 4-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-3-methyl-thiazol-3-ium-2-amine bromide CAS Name: 4-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-3-methyl-2-thiazol-3-iumamine bromide IUPAC Name: 4-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-3-methyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [4-(4-chlorophenyl)-3-methyl-thiazol-3-ium-2-yl]-(2,6-dimethylphenyl)amine bromide Formula: C18H18BrClN2S MolecularWeight: 409.77092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Cl)C.[Br-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Cl)C.[Br-]

InChI

InChI=1S/C18H17ClN2S.BrH/c1-12-5-4-6-13(2)17(12)20-18-21(3)16(11-22-18)14-7-9-15(19)10-8-14;/h4-11H,1-3H3;1H