1-(5-bromanyl-2-methylsulfanyl-1H-imidazol-4-yl)-2-methyl-prop-2-en-1-one

Systemtic Name: 1-(5-bromanyl-2-methylsulfanyl-1H-imidazol-4-yl)-2-methyl-prop-2-en-1-one Openeye Name: 1-(5-bromo-2-methylsulfanyl-1H-imidazol-4-yl)-2-methyl-prop-2-en-1-one CAS Name: 1-[5-bromo-2-(methylthio)-1H-imidazol-4-yl]-2-methyl-2-propen-1-one IUPAC Name: 1-(5-bromo-2-methylsulfanyl-1H-imidazol-4-yl)-2-methylprop-2-en-1-one Traditional Name: 1-[5-bromo-2-(methylthio)-1H-imidazol-4-yl]-2-methyl-prop-2-en-1-one Formula: C8H9BrN2OS MolecularWeight: 261.13886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)C1=C(NC(=N1)SC)Br

Isomeric SMILES

CC(=C)C(=O)C1=C(NC(=N1)SC)Br

InChI

InChI=1S/C8H9BrN2OS/c1-4(2)6(12)5-7(9)11-8(10-5)13-3/h1H2,2-3H3,(H,10,11)