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

Systemtic Name: 2-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]-1,3-benzoxazole CAS Name: 2-[4-[[3-(2-pyrazinyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazin-4-iumyl]-1,3-benzoxazole IUPAC Name: 2-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]-1,3-benzoxazole Formula: C18H18N7O2+ MolecularWeight: 364.38122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NO2)C3=NC=CN=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NO2)C3=NC=CN=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C18H17N7O2/c1-2-4-15-13(3-1)21-18(26-15)25-9-7-24(8-10-25)12-16-22-17(23-27-16)14-11-19-5-6-20-14/h1-6,11H,7-10,12H2/p+1