2-[(4-tert-butylphenyl)methylsulfanyl]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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