N-tert-butyl-4-phenyl-3-(phenylmethyl)-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: N-tert-butyl-4-phenyl-3-(phenylmethyl)-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 3-benzyl-N-tert-butyl-4-phenyl-thiazol-3-ium-2-amine bromide CAS Name: N-tert-butyl-4-phenyl-3-(phenylmethyl)-2-thiazol-3-iumamine bromide IUPAC Name: 3-benzyl-N-tert-butyl-4-phenyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: (3-benzyl-4-phenyl-thiazol-3-ium-2-yl)-tert-butyl-amine bromide Formula: C20H23BrN2S MolecularWeight: 403.37902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=[N+](C(=CS1)C2=CC=CC=C2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

CC(C)(C)NC1=[N+](C(=CS1)C2=CC=CC=C2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C20H22N2S.BrH/c1-20(2,3)21-19-22(14-16-10-6-4-7-11-16)18(15-23-19)17-12-8-5-9-13-17;/h4-13,15H,14H2,1-3H3;1H