5-[3-(2-methylphenyl)-1,2,4-oxadiazol-4-ium-5-yl]-N-(pyridin-2-ylmethyl)pyridin-2-amine

Systemtic Name: 5-[3-(2-methylphenyl)-1,2,4-oxadiazol-4-ium-5-yl]-N-(pyridin-2-ylmethyl)pyridin-2-amine Openeye Name: 5-[3-(o-tolyl)-1,2,4-oxadiazol-4-ium-5-yl]-N-(2-pyridylmethyl)pyridin-2-amine CAS Name: 5-[3-(2-methylphenyl)-1,2,4-oxadiazol-4-ium-5-yl]-N-(2-pyridinylmethyl)-2-pyridinamine IUPAC Name: 5-[3-(2-methylphenyl)-1,2,4-oxadiazol-4-ium-5-yl]-N-(pyridin-2-ylmethyl)pyridin-2-amine Traditional Name: [5-[3-(o-tolyl)-1,2,4-oxadiazol-4-ium-5-yl]-2-pyridyl]-(2-pyridylmethyl)amine Formula: C20H18N5O+ MolecularWeight: 344.38982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=[NH+]2)C3=CN=C(C=C3)NCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=[NH+]2)C3=CN=C(C=C3)NCC4=CC=CC=N4

InChI

InChI=1S/C20H17N5O/c1-14-6-2-3-8-17(14)19-24-20(26-25-19)15-9-10-18(22-12-15)23-13-16-7-4-5-11-21-16/h2-12H,13H2,1H3,(H,22,23)/p+1