2-oxidanidyl-4-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,5-oxadiazol-2-ium

Systemtic Name: 2-oxidanidyl-4-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,5-oxadiazol-2-ium Openeye Name: 2-oxido-4-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,5-oxadiazol-2-ium CAS Name: 2-oxido-4-phenyl-3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,2,5-oxadiazol-2-ium IUPAC Name: 2-oxido-4-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,5-oxadiazol-2-ium Traditional Name: 2-oxido-4-phenyl-3-[[4-(2-pyrimidyl)piperazino]methyl]furazan-2-ium Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=[N+](ON=C2C3=CC=CC=C3)[O-])C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=[N+](ON=C2C3=CC=CC=C3)[O-])C4=NC=CC=N4

InChI

InChI=1S/C17H18N6O2/c24-23-15(16(20-25-23)14-5-2-1-3-6-14)13-21-9-11-22(12-10-21)17-18-7-4-8-19-17/h1-8H,9-13H2