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

Systemtic Name: tert-butyl 4-[5-[(3-methylphenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-(m-tolylmethylsulfanyl)-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[5-[(3-methylphenyl)methylthio]-1,3,4-oxadiazol-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-[(3-methylphenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[5-[(3-methylbenzyl)thio]-1,3,4-oxadiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(O2)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(O2)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27N3O3S/c1-14-6-5-7-15(12-14)13-27-18-22-21-17(25-18)16-8-10-23(11-9-16)19(24)26-20(2,3)4/h5-7,12,16H,8-11,13H2,1-4H3