5-(4-pyridin-2-ylbut-3-ynyl)-3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-(4-pyridin-2-ylbut-3-ynyl)-3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Openeye Name: 5-[4-(2-pyridyl)but-3-ynyl]-3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazole CAS Name: 5-[4-(2-pyridinyl)but-3-ynyl]-3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-pyridin-2-ylbut-3-ynyl)-3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Traditional Name: 5-[4-(2-pyridyl)but-3-ynyl]-3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Formula: C18H12F3N3O MolecularWeight: 343.30259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NOC(=N2)CCC#CC3=CC=CC=N3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NOC(=N2)CCC#CC3=CC=CC=N3)C(F)(F)F

InChI

InChI=1S/C18H12F3N3O/c19-18(20,21)15-10-3-2-9-14(15)17-23-16(25-24-17)11-4-1-7-13-8-5-6-12-22-13/h2-3,5-6,8-10,12H,4,11H2