N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C24H30N5O2+ MolecularWeight: 420.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CN(N=C1C2=CN=CC=C2)CC3=CC=CC=C3)[NH+]4CCOCC4

Isomeric SMILES

CC(C)(CNC(=O)C1=CN(N=C1C2=CN=CC=C2)CC3=CC=CC=C3)[NH+]4CCOCC4

InChI

InChI=1S/C24H29N5O2/c1-24(2,28-11-13-31-14-12-28)18-26-23(30)21-17-29(16-19-7-4-3-5-8-19)27-22(21)20-9-6-10-25-15-20/h3-10,15,17H,11-14,16,18H2,1-2H3,(H,26,30)/p+1