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

Systemtic Name: 2-[2-(3-methylphenyl)-1,3-thiazol-3-ium-4-yl]ethylazanium dibromide Openeye Name: 2-[2-(m-tolyl)thiazol-3-ium-4-yl]ethylammonium dibromide CAS Name: 2-[2-(3-methylphenyl)-4-thiazol-3-iumyl]ethylammonium dibromide IUPAC Name: 2-[2-(3-methylphenyl)-1,3-thiazol-3-ium-4-yl]ethylazanium dibromide Traditional Name: 2-[2-(m-tolyl)thiazol-3-ium-4-yl]ethylammonium dibromide Formula: C12H16Br2N2S MolecularWeight: 380.14184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=[NH+]C(=CS2)CC[NH3+].[Br-].[Br-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=[NH+]C(=CS2)CC[NH3+].[Br-].[Br-]

InChI

InChI=1S/C12H14N2S.2BrH/c1-9-3-2-4-10(7-9)12-14-11(5-6-13)8-15-12;;/h2-4,7-8H,5-6,13H2,1H3;2*1H