N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-thiophen-3-yl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-thiophen-3-yl-1H-pyrazole-5-carboxamide Openeye Name: N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(3-thienyl)-1H-pyrazole-5-carboxamide CAS Name: N-[[1-[2-(4-fluorophenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N-methyl-3-(3-thiophenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-thiophen-3-yl-1H-pyrazole-5-carboxamide Traditional Name: N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(3-thienyl)-1H-pyrazole-5-carboxamide Formula: C23H28FN4OS+ MolecularWeight: 427.558023

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CC[NH+](CC1)CCC2=CC=C(C=C2)F)C(=O)C3=CC(=NN3)C4=CSC=C4

Isomeric SMILES

CN(CC1CC[NH+](CC1)CCC2=CC=C(C=C2)F)C(=O)C3=CC(=NN3)C4=CSC=C4

InChI

InChI=1S/C23H27FN4OS/c1-27(23(29)22-14-21(25-26-22)19-9-13-30-16-19)15-18-7-11-28(12-8-18)10-6-17-2-4-20(24)5-3-17/h2-5,9,13-14,16,18H,6-8,10-12,15H2,1H3,(H,25,26)/p+1