N-cyclopropyl-2-[3-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-2-yl]ethanamide bromide

Systemtic Name: N-cyclopropyl-2-[3-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-2-yl]ethanamide bromide Openeye Name: N-cyclopropyl-2-[3-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-2-yl]acetamide bromide CAS Name: N-cyclopropyl-2-[3-[5-[(3,5-dimethyl-1-pyrazolyl)methyl]-1H-pyrazol-3-yl]-2-pyridin-1-iumyl]acetamide bromide IUPAC Name: N-cyclopropyl-2-[3-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-2-yl]acetamide bromide Traditional Name: N-cyclopropyl-2-[3-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-2-yl]acetamide bromide Formula: C19H23BrN6O MolecularWeight: 431.32952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC(=NN2)C3=C([NH+]=CC=C3)CC(=O)NC4CC4)C.[Br-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC(=NN2)C3=C([NH+]=CC=C3)CC(=O)NC4CC4)C.[Br-]

InChI

InChI=1S/C19H22N6O.BrH/c1-12-8-13(2)25(24-12)11-15-9-18(23-22-15)16-4-3-7-20-17(16)10-19(26)21-14-5-6-14;/h3-4,7-9,14H,5-6,10-11H2,1-2H3,(H,21,26)(H,22,23);1H