tert-butyl N-[2-phenyl-1-[5-(phenylmethylsulfanyl)-1,3,4-oxadiazol-2-yl]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-phenyl-1-[5-(phenylmethylsulfanyl)-1,3,4-oxadiazol-2-yl]ethyl]carbamate Openeye Name: tert-butyl N-[1-(5-benzylsulfanyl-1,3,4-oxadiazol-2-yl)-2-phenyl-ethyl]carbamate CAS Name: N-[2-phenyl-1-[5-(phenylmethylthio)-1,3,4-oxadiazol-2-yl]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(5-benzylsulfanyl-1,3,4-oxadiazol-2-yl)-2-phenylethyl]carbamate Traditional Name: N-[1-[5-(benzylthio)-1,3,4-oxadiazol-2-yl]-2-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2=NN=C(O2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2=NN=C(O2)SCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3S/c1-22(2,3)28-20(26)23-18(14-16-10-6-4-7-11-16)19-24-25-21(27-19)29-15-17-12-8-5-9-13-17/h4-13,18H,14-15H2,1-3H3,(H,23,26)