2-[2-(3-bromophenyl)-1,3-thiazol-3-ium-4-yl]ethylazanium dibromide

Systemtic Name: 2-[2-(3-bromophenyl)-1,3-thiazol-3-ium-4-yl]ethylazanium dibromide Openeye Name: 2-[2-(3-bromophenyl)thiazol-3-ium-4-yl]ethylammonium dibromide CAS Name: 2-[2-(3-bromophenyl)-4-thiazol-3-iumyl]ethylammonium dibromide IUPAC Name: 2-[2-(3-bromophenyl)-1,3-thiazol-3-ium-4-yl]ethylazanium dibromide Traditional Name: 2-[2-(3-bromophenyl)thiazol-3-ium-4-yl]ethylammonium dibromide Formula: C11H13Br3N2S MolecularWeight: 445.01132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=[NH+]C(=CS2)CC[NH3+].[Br-].[Br-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=[NH+]C(=CS2)CC[NH3+].[Br-].[Br-]

InChI

InChI=1S/C11H11BrN2S.2BrH/c12-9-3-1-2-8(6-9)11-14-10(4-5-13)7-15-11;;/h1-3,6-7H,4-5,13H2;2*1H