2-[2-[(4-bromophenyl)-phenyl-methyl]-1,3-thiazol-4-yl]ethylazanium bromide

Systemtic Name: 2-[2-[(4-bromophenyl)-phenyl-methyl]-1,3-thiazol-4-yl]ethylazanium bromide Openeye Name: 2-[2-[(4-bromophenyl)-phenyl-methyl]thiazol-4-yl]ethylammonium bromide CAS Name: 2-[2-[(4-bromophenyl)-phenylmethyl]-4-thiazolyl]ethylammonium bromide IUPAC Name: 2-[2-[(4-bromophenyl)-phenylmethyl]-1,3-thiazol-4-yl]ethylazanium bromide Traditional Name: 2-[2-[(4-bromophenyl)-phenyl-methyl]thiazol-4-yl]ethylammonium bromide Formula: C18H18Br2N2S MolecularWeight: 454.22192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)C3=NC(=CS3)CC[NH3+].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)C3=NC(=CS3)CC[NH3+].[Br-]

InChI

InChI=1S/C18H17BrN2S.BrH/c19-15-8-6-14(7-9-15)17(13-4-2-1-3-5-13)18-21-16(10-11-20)12-22-18;/h1-9,12,17H,10-11,20H2;1H