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

Systemtic Name: 5-cyclopropyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-N-[[2-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-pyridin-1-iumyl]methyl]-1H-pyrazole-3-carboxamide IUPAC Name: 5-cyclopropyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]-1H-pyrazole-3-carboxamide Formula: C21H25N6O+ MolecularWeight: 377.4628

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2=C(C=CC=[NH+]2)CNC(=O)C3=NNC(=C3)C4CC4

Isomeric SMILES

CN(CCC1=CC=CC=N1)C2=C(C=CC=[NH+]2)CNC(=O)C3=NNC(=C3)C4CC4

InChI

InChI=1S/C21H24N6O/c1-27(12-9-17-6-2-3-10-22-17)20-16(5-4-11-23-20)14-24-21(28)19-13-18(25-26-19)15-7-8-15/h2-6,10-11,13,15H,7-9,12,14H2,1H3,(H,24,28)(H,25,26)/p+1