3-[3-methyl-7-[(5-methyl-1H-imidazol-3-ium-4-yl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]-5-pyridin-3-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-3-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-(3-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-(3-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-3-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-(3-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=CN=CC=C5

Isomeric SMILES

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

InChI

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