5-phenyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 5-phenyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 5-phenyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 5-phenyl-N-[3-(1-pyrrolidin-1-iumyl)propyl]-7-(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 5-phenyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 5-phenyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C21H23F3N5O+ MolecularWeight: 418.43543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNC(=O)C2=C3N=C(C=C(N3N=C2)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)CCCNC(=O)C2=C3N=C(C=C(N3N=C2)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C21H22F3N5O/c22-21(23,24)18-13-17(15-7-2-1-3-8-15)27-19-16(14-26-29(18)19)20(30)25-9-6-12-28-10-4-5-11-28/h1-3,7-8,13-14H,4-6,9-12H2,(H,25,30)/p+1