3-[3-methyl-7-[(5-methyl-1H-imidazol-3-ium-4-yl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]-5-pyridin-2-yl-1,2,4-oxadiazole

Systemtic Name: 3-[3-methyl-7-[(5-methyl-1H-imidazol-3-ium-4-yl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]-5-pyridin-2-yl-1,2,4-oxadiazole Openeye Name: 3-[3-methyl-7-[(5-methyl-1H-imidazol-3-ium-4-yl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]-5-(2-pyridyl)-1,2,4-oxadiazole CAS Name: 3-[3-methyl-7-[(5-methyl-1H-imidazol-3-ium-4-yl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]-5-(2-pyridinyl)-1,2,4-oxadiazole IUPAC Name: 3-[3-methyl-7-[(5-methyl-1H-imidazol-3-ium-4-yl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]-5-pyridin-2-yl-1,2,4-oxadiazole Traditional Name: 3-[3-methyl-7-[(5-methyl-1H-imidazol-3-ium-4-yl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]-5-(2-pyridyl)-1,2,4-oxadiazole Formula: C21H22N7O+ MolecularWeight: 388.44568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=CN1)CN2CCC3=C(C(=NC=C3C2)C)C4=NOC(=N4)C5=CC=CC=N5

Isomeric SMILES

CC1=C([NH+]=CN1)CN2CCC3=C(C(=NC=C3C2)C)C4=NOC(=N4)C5=CC=CC=N5

InChI

InChI=1S/C21H21N7O/c1-13-18(25-12-24-13)11-28-8-6-16-15(10-28)9-23-14(2)19(16)20-26-21(29-27-20)17-5-3-4-7-22-17/h3-5,7,9,12H,6,8,10-11H2,1-2H3,(H,24,25)/p+1