tert-butyl 4-[[3-(2-fluoranyl-4-methylsulfanyl-phenyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(2-fluoranyl-4-methylsulfanyl-phenyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(2-fluoro-4-methylsulfanyl-phenyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylate CAS Name: 4-[[3-[2-fluoro-4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]methoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(2-fluoro-4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylate Traditional Name: 4-[[3-[2-fluoro-4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H26FN3O4S MolecularWeight: 423.501543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OCC2=NC(=NO2)C3=C(C=C(C=C3)SC)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OCC2=NC(=NO2)C3=C(C=C(C=C3)SC)F

InChI

InChI=1S/C20H26FN3O4S/c1-20(2,3)27-19(25)24-9-7-13(8-10-24)26-12-17-22-18(23-28-17)15-6-5-14(29-4)11-16(15)21/h5-6,11,13H,7-10,12H2,1-4H3