tert-butyl 2-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate CAS Name: 2-[5-[(2-chloro-6-fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: 2-[5-[(2-chloro-6-fluoro-benzyl)thio]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H21ClFN3O3S MolecularWeight: 413.894043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C2=NN=C(O2)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C2=NN=C(O2)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H21ClFN3O3S/c1-18(2,3)26-17(24)23-9-5-8-14(23)15-21-22-16(25-15)27-10-11-12(19)6-4-7-13(11)20/h4,6-7,14H,5,8-10H2,1-3H3