methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid methyl ester Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N1C2=CC=CC=C2)SC

Isomeric SMILES

COC(=O)C1=CN=C(N1C2=CC=CC=C2)SC

InChI

InChI=1S/C12H12N2O2S/c1-16-11(15)10-8-13-12(17-2)14(10)9-6-4-3-5-7-9/h3-8H,1-2H3