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

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-(4-pyridyl)-1,3,4-oxadiazole CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-5-pyridin-4-yl-1,3,4-oxadiazole IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-5-(4-pyridyl)-1,3,4-oxadiazole Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3OS/c1-13-10-16(20(3,4)5)11-14(2)17(13)12-25-19-23-22-18(24-19)15-6-8-21-9-7-15/h6-11H,12H2,1-5H3