2-(2-ethanoylphenoxy)ethyl 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate

Systemtic Name: 2-(2-ethanoylphenoxy)ethyl 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate Openeye Name: 2-(2-acetylphenoxy)ethyl 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-2-(methylthio)-4-imidazolecarboxylic acid 2-(2-acetylphenoxy)ethyl ester IUPAC Name: 2-(2-acetylphenoxy)ethyl 3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carboxylic acid 2-(2-acetylphenoxy)ethyl ester Formula: C21H19FN2O4S MolecularWeight: 414.449963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OCCOC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CC(=O)C1=CC=CC=C1OCCOC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H19FN2O4S/c1-14(25)17-5-3-4-6-19(17)27-11-12-28-20(26)18-13-23-21(29-2)24(18)16-9-7-15(22)8-10-16/h3-10,13H,11-12H2,1-2H3