2-[2-(2-ethanoylhydrazinyl)-4-phenyl-1,3-thiazol-3-ium-5-yl]ethanoic acid bromide

Systemtic Name: 2-[2-(2-ethanoylhydrazinyl)-4-phenyl-1,3-thiazol-3-ium-5-yl]ethanoic acid bromide Openeye Name: 2-[2-(2-acetylhydrazino)-4-phenyl-thiazol-3-ium-5-yl]acetic acid bromide CAS Name: 2-[2-(acetylhydrazo)-4-phenyl-5-thiazol-3-iumyl]acetic acid bromide IUPAC Name: 2-[2-(2-acetylhydrazinyl)-4-phenyl-1,3-thiazol-3-ium-5-yl]acetic acid bromide Traditional Name: 2-[2-(N'-acetylhydrazino)-4-phenyl-thiazol-3-ium-5-yl]acetic acid bromide Formula: C13H14BrN3O3S MolecularWeight: 372.23756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NNC1=[NH+]C(=C(S1)CC(=O)O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

CC(=O)NNC1=[NH+]C(=C(S1)CC(=O)O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C13H13N3O3S.BrH/c1-8(17)15-16-13-14-12(9-5-3-2-4-6-9)10(20-13)7-11(18)19;/h2-6H,7H2,1H3,(H,14,16)(H,15,17)(H,18,19);1H