methyl 1-[2-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]oxyacetyl]isonipecotic acid methyl ester Formula: C20H22FN3O5S MolecularWeight: 435.469183

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C20H22FN3O5S/c1-28-18(26)13-7-9-23(10-8-13)17(25)12-29-19(27)16-11-22-20(30-2)24(16)15-5-3-14(21)4-6-15/h3-6,11,13H,7-10,12H2,1-2H3