3-ethyl-4-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: 3-ethyl-4-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 3-ethyl-4-(p-tolyl)-N-[3-(trifluoromethyl)phenyl]thiazol-3-ium-2-amine bromide CAS Name: 3-ethyl-4-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]-2-thiazol-3-iumamine bromide IUPAC Name: 3-ethyl-4-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [3-ethyl-4-(p-tolyl)thiazol-3-ium-2-yl]-[3-(trifluoromethyl)phenyl]amine bromide Formula: C19H18BrF3N2S MolecularWeight: 443.32383

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC=C1C2=CC=C(C=C2)C)NC3=CC=CC(=C3)C(F)(F)F.[Br-]

Isomeric SMILES

CC[N+]1=C(SC=C1C2=CC=C(C=C2)C)NC3=CC=CC(=C3)C(F)(F)F.[Br-]

InChI

InChI=1S/C19H17F3N2S.BrH/c1-3-24-17(14-9-7-13(2)8-10-14)12-25-18(24)23-16-6-4-5-15(11-16)19(20,21)22;/h4-12H,3H2,1-2H3;1H