3-[[2-(3-fluorophenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-(3-fluorophenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(3-fluorophenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(3-fluorophenyl)-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(3-fluorophenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(3-fluorophenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-ammonium Formula: C23H25FN5+ MolecularWeight: 390.476503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=CC(=NC2=CC(=NN21)C3=CC(=CC=C3)F)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)CCCNC1=CC(=NC2=CC(=NN21)C3=CC(=CC=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C23H24FN5/c1-28(2)13-7-12-25-22-15-20(17-8-4-3-5-9-17)26-23-16-21(27-29(22)23)18-10-6-11-19(24)14-18/h3-6,8-11,14-16,25H,7,12-13H2,1-2H3/p+1