N-[3,5-bis(trifluoromethyl)phenyl]-4-tert-butyl-3-methyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-tert-butyl-3-methyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-tert-butyl-3-methyl-thiazol-3-ium-2-amine bromide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-tert-butyl-3-methyl-2-thiazol-3-iumamine bromide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-tert-butyl-3-methyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-(4-tert-butyl-3-methyl-thiazol-3-ium-2-yl)amine bromide Formula: C16H17BrF6N2S MolecularWeight: 463.278999

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=[N+]1C)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.[Br-]

Isomeric SMILES

CC(C)(C)C1=CSC(=[N+]1C)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.[Br-]

InChI

InChI=1S/C16H16F6N2S.BrH/c1-14(2,3)12-8-25-13(24(12)4)23-11-6-9(15(17,18)19)5-10(7-11)16(20,21)22;/h5-8H,1-4H3;1H