ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]amino]benzoic acid ethyl ester Formula: C20H18FN3O3S MolecularWeight: 399.438623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18FN3O3S/c1-3-27-19(26)13-4-8-15(9-5-13)23-18(25)17-12-22-20(28-2)24(17)16-10-6-14(21)7-11-16/h4-12H,3H2,1-2H3,(H,23,25)