methyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium

Systemtic Name: methyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium Openeye Name: methyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]ammonium CAS Name: methyl-[[3-(2-pyrazinyl)-1,2,4-oxadiazol-5-yl]methyl]-[[4-(1-pyrazolyl)phenyl]methyl]ammonium IUPAC Name: methyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium Traditional Name: methyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-(4-pyrazol-1-ylbenzyl)ammonium Formula: C18H18N7O+ MolecularWeight: 348.38182

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)CC3=NC(=NO3)C4=NC=CN=C4

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)CC3=NC(=NO3)C4=NC=CN=C4

InChI

InChI=1S/C18H17N7O/c1-24(12-14-3-5-15(6-4-14)25-10-2-7-21-25)13-17-22-18(23-26-17)16-11-19-8-9-20-16/h2-11H,12-13H2,1H3/p+1