3-(2,6-dimethylphenyl)-5-(4-pyridin-2-ylbut-3-ynyl)-1,2,4-oxadiazole

Systemtic Name: 3-(2,6-dimethylphenyl)-5-(4-pyridin-2-ylbut-3-ynyl)-1,2,4-oxadiazole Openeye Name: 3-(2,6-dimethylphenyl)-5-[4-(2-pyridyl)but-3-ynyl]-1,2,4-oxadiazole CAS Name: 3-(2,6-dimethylphenyl)-5-[4-(2-pyridinyl)but-3-ynyl]-1,2,4-oxadiazole IUPAC Name: 3-(2,6-dimethylphenyl)-5-(4-pyridin-2-ylbut-3-ynyl)-1,2,4-oxadiazole Traditional Name: 3-(2,6-dimethylphenyl)-5-[4-(2-pyridyl)but-3-ynyl]-1,2,4-oxadiazole Formula: C19H17N3O MolecularWeight: 303.35778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=NOC(=N2)CCC#CC3=CC=CC=N3

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=NOC(=N2)CCC#CC3=CC=CC=N3

InChI

InChI=1S/C19H17N3O/c1-14-8-7-9-15(2)18(14)19-21-17(23-22-19)12-4-3-10-16-11-5-6-13-20-16/h5-9,11,13H,4,12H2,1-2H3