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

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-[(4-tert-butylphenyl)methylthio]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(4-tert-butylbenzyl)thio]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C21H24N2O3S/c1-21(2,3)16-8-6-14(7-9-16)13-27-20-23-22-19(26-20)15-10-17(24-4)12-18(11-15)25-5/h6-12H,13H2,1-5H3