5-methyl-N-(1-methylpiperidin-1-ium-4-yl)-1-(4-pyridin-3-ylpyrimidin-2-yl)pyrazole-4-carboxamide

Systemtic Name: 5-methyl-N-(1-methylpiperidin-1-ium-4-yl)-1-(4-pyridin-3-ylpyrimidin-2-yl)pyrazole-4-carboxamide Openeye Name: 5-methyl-N-(1-methylpiperidin-1-ium-4-yl)-1-[4-(3-pyridyl)pyrimidin-2-yl]pyrazole-4-carboxamide CAS Name: 5-methyl-N-(1-methyl-4-piperidin-1-iumyl)-1-[4-(3-pyridinyl)-2-pyrimidinyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-N-(1-methylpiperidin-1-ium-4-yl)-1-(4-pyridin-3-ylpyrimidin-2-yl)pyrazole-4-carboxamide Traditional Name: 5-methyl-N-(1-methylpiperidin-1-ium-4-yl)-1-[4-(3-pyridyl)pyrimidin-2-yl]pyrazole-4-carboxamide Formula: C20H24N7O+ MolecularWeight: 378.45086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=CC(=N2)C3=CN=CC=C3)C(=O)NC4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C=NN1C2=NC=CC(=N2)C3=CN=CC=C3)C(=O)NC4CC[NH+](CC4)C

InChI

InChI=1S/C20H23N7O/c1-14-17(19(28)24-16-6-10-26(2)11-7-16)13-23-27(14)20-22-9-5-18(25-20)15-4-3-8-21-12-15/h3-5,8-9,12-13,16H,6-7,10-11H2,1-2H3,(H,24,28)/p+1