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

Systemtic Name: tert-butyl 4-[[3-(3-methyl-4-methylsulfanyl-phenyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(3-methyl-4-methylsulfanyl-phenyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylate CAS Name: 4-[[3-[3-methyl-4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]methoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(3-methyl-4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylate Traditional Name: 4-[[3-[3-methyl-4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]methoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29N3O4S MolecularWeight: 419.53766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NOC(=N2)COC3CCN(CC3)C(=O)OC(C)(C)C)SC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NOC(=N2)COC3CCN(CC3)C(=O)OC(C)(C)C)SC

InChI

InChI=1S/C21H29N3O4S/c1-14-12-15(6-7-17(14)29-5)19-22-18(28-23-19)13-26-16-8-10-24(11-9-16)20(25)27-21(2,3)4/h6-7,12,16H,8-11,13H2,1-5H3