7-[bis(fluoranyl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 7-[bis(fluoranyl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 7-(difluoromethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 7-(difluoromethyl)-N-[3-(4-morpholin-4-iumyl)propyl]-5-phenyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 7-(difluoromethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 7-(difluoromethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C21H24F2N5O2+ MolecularWeight: 416.444366

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=C3N=C(C=C(N3N=C2)C(F)F)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=C3N=C(C=C(N3N=C2)C(F)F)C4=CC=CC=C4

InChI

InChI=1S/C21H23F2N5O2/c22-19(23)18-13-17(15-5-2-1-3-6-15)26-20-16(14-25-28(18)20)21(29)24-7-4-8-27-9-11-30-12-10-27/h1-3,5-6,13-14,19H,4,7-12H2,(H,24,29)/p+1