3-bromanyl-5-ethyl-N-[(1-oxidanidylpyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 3-bromanyl-5-ethyl-N-[(1-oxidanidylpyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 3-bromo-5-ethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 3-bromo-5-ethyl-N-[(1-oxido-3-pyridin-1-iumyl)methyl]-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 3-bromo-5-ethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (3-bromo-5-ethyl-pyrazolo[1,5-a]pyrimidin-7-yl)-[(1-oxidopyridin-1-ium-3-yl)methyl]amine Formula: C14H14BrN5O MolecularWeight: 348.19786

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=NN2C(=C1)NCC3=C[N+](=CC=C3)[O-])Br

Isomeric SMILES

CCC1=NC2=C(C=NN2C(=C1)NCC3=C[N+](=CC=C3)[O-])Br

InChI

InChI=1S/C14H14BrN5O/c1-2-11-6-13(20-14(18-11)12(15)8-17-20)16-7-10-4-3-5-19(21)9-10/h3-6,8-9,16H,2,7H2,1H3