methyl 5-bromanyl-3-methyl-2-methylsulfanyl-imidazole-4-carboxylate

Systemtic Name: methyl 5-bromanyl-3-methyl-2-methylsulfanyl-imidazole-4-carboxylate Openeye Name: methyl 5-bromo-3-methyl-2-methylsulfanyl-imidazole-4-carboxylate CAS Name: 5-bromo-3-methyl-2-(methylthio)-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-methyl-2-methylsulfanylimidazole-4-carboxylate Traditional Name: 5-bromo-3-methyl-2-(methylthio)imidazole-4-carboxylic acid methyl ester Formula: C7H9BrN2O2S MolecularWeight: 265.12756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1SC)Br)C(=O)OC

Isomeric SMILES

CN1C(=C(N=C1SC)Br)C(=O)OC

InChI

InChI=1S/C7H9BrN2O2S/c1-10-4(6(11)12-2)5(8)9-7(10)13-3/h1-3H3