5-methyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-methyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide Openeye Name: 5-methyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide CAS Name: 5-methyl-N-[[2-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-pyridin-1-iumyl]methyl]-1H-pyrazole-3-carboxamide IUPAC Name: 5-methyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide Traditional Name: 5-methyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide Formula: C19H23N6O+ MolecularWeight: 351.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)NCC2=C([NH+]=CC=C2)N(C)CCC3=CC=CC=N3

Isomeric SMILES

CC1=CC(=NN1)C(=O)NCC2=C([NH+]=CC=C2)N(C)CCC3=CC=CC=N3

InChI

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