3-ethyl-4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: 3-ethyl-4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 3-ethyl-4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiazol-3-ium-2-amine bromide CAS Name: 3-ethyl-4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)-2-thiazol-3-iumamine bromide IUPAC Name: 3-ethyl-4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [3-ethyl-4-(4-methoxyphenyl)thiazol-3-ium-2-yl]-mesityl-amine bromide Formula: C21H25BrN2OS MolecularWeight: 433.405

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC=C1C2=CC=C(C=C2)OC)NC3=C(C=C(C=C3C)C)C.[Br-]

Isomeric SMILES

CC[N+]1=C(SC=C1C2=CC=C(C=C2)OC)NC3=C(C=C(C=C3C)C)C.[Br-]

InChI

InChI=1S/C21H24N2OS.BrH/c1-6-23-19(17-7-9-18(24-5)10-8-17)13-25-21(23)22-20-15(3)11-14(2)12-16(20)4;/h7-13H,6H2,1-5H3;1H