2-(4-tert-butylphenyl)-5-[4-(2-pyridin-4-ylethynyl)phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-tert-butylphenyl)-5-[4-(2-pyridin-4-ylethynyl)phenyl]-1,3,4-oxadiazole Openeye Name: 2-(4-tert-butylphenyl)-5-[4-[2-(4-pyridyl)ethynyl]phenyl]-1,3,4-oxadiazole CAS Name: 2-(4-tert-butylphenyl)-5-[4-(2-pyridin-4-ylethynyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-(4-tert-butylphenyl)-5-[4-(2-pyridin-4-ylethynyl)phenyl]-1,3,4-oxadiazole Traditional Name: 2-(4-tert-butylphenyl)-5-[4-[2-(4-pyridyl)ethynyl]phenyl]-1,3,4-oxadiazole Formula: C25H21N3O MolecularWeight: 379.45374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C#CC4=CC=NC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C#CC4=CC=NC=C4

InChI

InChI=1S/C25H21N3O/c1-25(2,3)22-12-10-21(11-13-22)24-28-27-23(29-24)20-8-6-18(7-9-20)4-5-19-14-16-26-17-15-19/h6-17H,1-3H3