2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-phenyl-1,3,4-oxadiazole

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-phenyl-1,3,4-oxadiazole Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-phenyl-1,3,4-oxadiazole CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-5-phenyl-1,3,4-oxadiazole IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-5-phenyl-1,3,4-oxadiazole Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NN=C(O2)C3=CC=CC=C3)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NN=C(O2)C3=CC=CC=C3)C)C(C)(C)C

InChI

InChI=1S/C21H24N2OS/c1-14-11-17(21(3,4)5)12-15(2)18(14)13-25-20-23-22-19(24-20)16-9-7-6-8-10-16/h6-12H,13H2,1-5H3