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

Systemtic Name: tert-butyl 4-[5-[(3-bromophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-[(3-bromophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[5-[(3-bromophenyl)methylthio]-1,3,4-oxadiazol-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-[(3-bromophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[5-[(3-bromobenzyl)thio]-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H24BrN3O3S MolecularWeight: 454.38116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NN=C(O2)SCC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NN=C(O2)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H24BrN3O3S/c1-19(2,3)26-18(24)23-9-7-14(8-10-23)16-21-22-17(25-16)27-12-13-5-4-6-15(20)11-13/h4-6,11,14H,7-10,12H2,1-3H3