ethyl 4-[2-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonyloxyethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonyloxyethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]oxyacetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethoxy]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]oxyacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]oxyacetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H25FN4O5S MolecularWeight: 464.510403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H25FN4O5S/c1-3-30-21(29)25-10-8-15(9-11-25)24-18(27)13-31-19(28)17-12-23-20(32-2)26(17)16-6-4-14(22)5-7-16/h4-7,12,15H,3,8-11,13H2,1-2H3,(H,24,27)