(5-fluoranyl-2-pyrazol-1-yl-phenyl)methyl-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]azanium

Systemtic Name: (5-fluoranyl-2-pyrazol-1-yl-phenyl)methyl-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]azanium Openeye Name: (5-fluoro-2-pyrazol-1-yl-phenyl)methyl-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]ammonium CAS Name: [5-fluoro-2-(1-pyrazolyl)phenyl]methyl-[(1S)-1-(5-methyl-1-phenyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: (5-fluoro-2-pyrazol-1-ylphenyl)methyl-[(1S)-1-(5-methyl-1-phenylpyrazol-4-yl)ethyl]azanium Traditional Name: (5-fluoro-2-pyrazol-1-yl-benzyl)-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]ammonium Formula: C22H23FN5+ MolecularWeight: 376.449923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)[NH2+]CC3=C(C=CC(=C3)F)N4C=CC=N4

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)[C@H](C)[NH2+]CC3=C(C=CC(=C3)F)N4C=CC=N4

InChI

InChI=1S/C22H22FN5/c1-16(21-15-26-28(17(21)2)20-7-4-3-5-8-20)24-14-18-13-19(23)9-10-22(18)27-12-6-11-25-27/h3-13,15-16,24H,14H2,1-2H3/p+1/t16-/m0/s1