[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium

Systemtic Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium Openeye Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)ammonium CAS Name: [1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl-[3-(1-pyrazolyl)propyl]ammonium IUPAC Name: [1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium Traditional Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)ammonium Formula: C24H28N5+ MolecularWeight: 386.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)C[NH2+]CCCN4C=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)C[NH2+]CCCN4C=CC=N4

InChI

InChI=1S/C24H27N5/c1-19-10-11-20(2)23(16-19)29-18-22(24(27-29)21-8-4-3-5-9-21)17-25-12-6-14-28-15-7-13-26-28/h3-5,7-11,13,15-16,18,25H,6,12,14,17H2,1-2H3/p+1