3-[(2-methylphenyl)methyl]-5-(4-pyridin-2-ylbut-3-ynyl)-1,2,4-oxadiazole

Systemtic Name: 3-[(2-methylphenyl)methyl]-5-(4-pyridin-2-ylbut-3-ynyl)-1,2,4-oxadiazole Openeye Name: 3-(o-tolylmethyl)-5-[4-(2-pyridyl)but-3-ynyl]-1,2,4-oxadiazole CAS Name: 3-[(2-methylphenyl)methyl]-5-[4-(2-pyridinyl)but-3-ynyl]-1,2,4-oxadiazole IUPAC Name: 3-[(2-methylphenyl)methyl]-5-(4-pyridin-2-ylbut-3-ynyl)-1,2,4-oxadiazole Traditional Name: 3-(2-methylbenzyl)-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=CC=CC=C1CC2=NOC(=N2)CCC#CC3=CC=CC=N3

Isomeric SMILES

CC1=CC=CC=C1CC2=NOC(=N2)CCC#CC3=CC=CC=N3

InChI

InChI=1S/C19H17N3O/c1-15-8-2-3-9-16(15)14-18-21-19(23-22-18)12-5-4-10-17-11-6-7-13-20-17/h2-3,6-9,11,13H,5,12,14H2,1H3