ethyl 4-(4-methylsulfanylphenyl)-1H-imidazole-5-carboxylate

Systemtic Name: ethyl 4-(4-methylsulfanylphenyl)-1H-imidazole-5-carboxylate Openeye Name: ethyl 4-(4-methylsulfanylphenyl)-1H-imidazole-5-carboxylate CAS Name: 4-[4-(methylthio)phenyl]-1H-imidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methylsulfanylphenyl)-1H-imidazole-5-carboxylate Traditional Name: 4-[4-(methylthio)phenyl]-1H-imidazole-5-carboxylic acid ethyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CN1)C2=CC=C(C=C2)SC

Isomeric SMILES

CCOC(=O)C1=C(N=CN1)C2=CC=C(C=C2)SC

InChI

InChI=1S/C13H14N2O2S/c1-3-17-13(16)12-11(14-8-15-12)9-4-6-10(18-2)7-5-9/h4-8H,3H2,1-2H3,(H,14,15)