2-(1,3-thiazol-3-ium-3-yl)-1-thiomorpholin-4-yl-ethanone bromide

Systemtic Name: 2-(1,3-thiazol-3-ium-3-yl)-1-thiomorpholin-4-yl-ethanone bromide Openeye Name: 2-thiazol-3-ium-3-yl-1-thiomorpholino-ethanone bromide CAS Name: 2-(3-thiazol-3-iumyl)-1-thiomorpholin-4-ylethanone bromide IUPAC Name: 2-(1,3-thiazol-3-ium-3-yl)-1-thiomorpholin-4-ylethanone bromide Traditional Name: 2-thiazol-3-ium-3-yl-1-thiomorpholino-ethanone bromide Formula: C9H13BrN2OS2 MolecularWeight: 309.24632

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)C[N+]2=CSC=C2.[Br-]

Isomeric SMILES

C1CSCCN1C(=O)C[N+]2=CSC=C2.[Br-]

InChI

InChI=1S/C9H13N2OS2.BrH/c12-9(7-10-1-4-14-8-10)11-2-5-13-6-3-11;/h1,4,8H,2-3,5-7H2;1H/q+1;/p-1