[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]azanium

Systemtic Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]azanium Openeye Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]ammonium CAS Name: [1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl-[(4,6-dimethyl-2-pyrimidinyl)methyl]ammonium IUPAC Name: [1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]azanium Traditional Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]ammonium Formula: C25H28N5+ MolecularWeight: 398.52332

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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+]CC4=NC(=CC(=N4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)C[NH2+]CC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C25H27N5/c1-17-10-11-18(2)23(12-17)30-16-22(25(29-30)21-8-6-5-7-9-21)14-26-15-24-27-19(3)13-20(4)28-24/h5-13,16,26H,14-15H2,1-4H3/p+1