5-(4-fluorophenyl)-2-(3-methylphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-2-(3-methylphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Openeye Name: 5-(4-fluorophenyl)-2-(m-tolyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide CAS Name: 5-(4-fluorophenyl)-2-(3-methylphenyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 5-(4-fluorophenyl)-2-(3-methylphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Traditional Name: 5-(4-fluorophenyl)-2-(m-tolyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Formula: C23H26FN4O+ MolecularWeight: 393.477143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)NCC[NH+]4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)NCC[NH+]4CCCC4

InChI

InChI=1S/C23H25FN4O/c1-17-5-4-6-20(15-17)28-22(23(29)25-11-14-27-12-2-3-13-27)16-21(26-28)18-7-9-19(24)10-8-18/h4-10,15-16H,2-3,11-14H2,1H3,(H,25,29)/p+1