tert-butyl 2-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate CAS Name: 2-[5-[(2-chlorophenyl)methylthio]-1,3,4-oxadiazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: 2-[5-[(2-chlorobenzyl)thio]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H22ClN3O3S MolecularWeight: 395.90358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN3O3S/c1-18(2,3)25-17(23)22-10-6-9-14(22)15-20-21-16(24-15)26-11-12-7-4-5-8-13(12)19/h4-5,7-8,14H,6,9-11H2,1-3H3