5-[[4-[(3-methylpyridin-2-yl)methyl]piperazin-1-ium-1-yl]methyl]-3-pyrazin-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-[(3-methylpyridin-2-yl)methyl]piperazin-1-ium-1-yl]methyl]-3-pyrazin-2-yl-1,2,4-oxadiazole Openeye Name: 5-[[4-[(3-methyl-2-pyridyl)methyl]piperazin-1-ium-1-yl]methyl]-3-pyrazin-2-yl-1,2,4-oxadiazole CAS Name: 5-[[4-[(3-methyl-2-pyridinyl)methyl]-1-piperazin-1-iumyl]methyl]-3-(2-pyrazinyl)-1,2,4-oxadiazole IUPAC Name: 5-[[4-[(3-methylpyridin-2-yl)methyl]piperazin-1-ium-1-yl]methyl]-3-pyrazin-2-yl-1,2,4-oxadiazole Traditional Name: 5-[[4-[(3-methyl-2-pyridyl)methyl]piperazin-1-ium-1-yl]methyl]-3-pyrazin-2-yl-1,2,4-oxadiazole Formula: C18H22N7O+ MolecularWeight: 352.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CN2CC[NH+](CC2)CC3=NC(=NO3)C4=NC=CN=C4

Isomeric SMILES

CC1=C(N=CC=C1)CN2CC[NH+](CC2)CC3=NC(=NO3)C4=NC=CN=C4

InChI

InChI=1S/C18H21N7O/c1-14-3-2-4-20-16(14)12-24-7-9-25(10-8-24)13-17-22-18(23-26-17)15-11-19-5-6-21-15/h2-6,11H,7-10,12-13H2,1H3/p+1