4-(4-nitrophenyl)-N-phenyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: 4-(4-nitrophenyl)-N-phenyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 4-(4-nitrophenyl)-N-phenyl-thiazol-3-ium-2-amine bromide CAS Name: 4-(4-nitrophenyl)-N-phenyl-2-thiazol-3-iumamine bromide IUPAC Name: 4-(4-nitrophenyl)-N-phenyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [4-(4-nitrophenyl)thiazol-3-ium-2-yl]-phenyl-amine bromide Formula: C15H12BrN3O2S MolecularWeight: 378.24368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=[NH+]C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=[NH+]C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C15H11N3O2S.BrH/c19-18(20)13-8-6-11(7-9-13)14-10-21-15(17-14)16-12-4-2-1-3-5-12;/h1-10H,(H,16,17);1H