8-ethyl-N-[(1-oxidanidylpyridin-1-ium-3-yl)methyl]-2-piperazin-1-yl-pyrazolo[1,5-a][1,3,5]triazin-4-amine

Systemtic Name: 8-ethyl-N-[(1-oxidanidylpyridin-1-ium-3-yl)methyl]-2-piperazin-1-yl-pyrazolo[1,5-a][1,3,5]triazin-4-amine Openeye Name: 8-ethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]-2-piperazin-1-yl-pyrazolo[1,5-a][1,3,5]triazin-4-amine CAS Name: 8-ethyl-N-[(1-oxido-3-pyridin-1-iumyl)methyl]-2-(1-piperazinyl)-4-pyrazolo[1,5-a][1,3,5]triazinamine IUPAC Name: 8-ethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]-2-piperazin-1-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine Traditional Name: (8-ethyl-2-piperazino-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-[(1-oxidopyridin-1-ium-3-yl)methyl]amine Formula: C17H22N8O MolecularWeight: 354.40958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2N=C(N=C(N2N=C1)NCC3=C[N+](=CC=C3)[O-])N4CCNCC4

Isomeric SMILES

CCC1=C2N=C(N=C(N2N=C1)NCC3=C[N+](=CC=C3)[O-])N4CCNCC4

InChI

InChI=1S/C17H22N8O/c1-2-14-11-20-25-15(14)21-17(23-8-5-18-6-9-23)22-16(25)19-10-13-4-3-7-24(26)12-13/h3-4,7,11-12,18H,2,5-6,8-10H2,1H3,(H,19,21,22)