4-bromanyl-2-methyl-1,2-thiazol-3-one hydrobromide

Systemtic Name: 4-bromanyl-2-methyl-1,2-thiazol-3-one hydrobromide Openeye Name: 4-bromo-2-methyl-isothiazol-3-one hydrobromide CAS Name: 4-bromo-2-methyl-3-isothiazolone hydrobromide IUPAC Name: 4-bromo-2-methyl-1,2-thiazol-3-one hydrobromide Traditional Name: 4-bromo-2-methyl-4-isothiazolin-3-one hydrobromide Formula: C4H5Br2NOS MolecularWeight: 274.9616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CS1)Br.Br

Isomeric SMILES

CN1C(=O)C(=CS1)Br.Br

InChI

InChI=1S/C4H4BrNOS.BrH/c1-6-4(7)3(5)2-8-6;/h2H,1H3;1H