2-bromanyl-5-methyl-1-methylsulfanylcarbonyl-imidazole-4-carboxylate

Systemtic Name: 2-bromanyl-5-methyl-1-methylsulfanylcarbonyl-imidazole-4-carboxylate Openeye Name: 2-bromo-5-methyl-1-methylsulfanylcarbonyl-imidazole-4-carboxylate CAS Name: 2-bromo-5-methyl-1-[(methylthio)-oxomethyl]-4-imidazolecarboxylate IUPAC Name: 2-bromo-5-methyl-1-methylsulfanylcarbonylimidazole-4-carboxylate Traditional Name: 2-bromo-5-methyl-1-(methylthio)carbonyl-imidazole-4-carboxylate Formula: C7H6BrN2O3S- MolecularWeight: 278.10314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1C(=O)SC)Br)C(=O)[O-]

Isomeric SMILES

CC1=C(N=C(N1C(=O)SC)Br)C(=O)[O-]

InChI

InChI=1S/C7H7BrN2O3S/c1-3-4(5(11)12)9-6(8)10(3)7(13)14-2/h1-2H3,(H,11,12)/p-1