5-(4-fluorophenyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-fluorophenyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-1H-pyrazole-4-carboxamide CAS Name: 5-(4-fluorophenyl)-N-[(2R)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-1H-pyrazole-4-carboxamide IUPAC Name: 5-(4-fluorophenyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]-1H-pyrazole-4-carboxamide Traditional Name: 5-(4-fluorophenyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-1H-pyrazole-4-carboxamide Formula: C22H26FN4OS+ MolecularWeight: 413.531443

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C22H25FN4OS/c1-15-8-10-27(11-9-15)19(20-3-2-12-29-20)14-24-22(28)18-13-25-26-21(18)16-4-6-17(23)7-5-16/h2-7,12-13,15,19H,8-11,14H2,1H3,(H,24,28)(H,25,26)/p+1/t19-/m1/s1