methyl-[[3-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl]-[(3-pyrazol-1-ylphenyl)methyl]azanium

Systemtic Name: methyl-[[3-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl]-[(3-pyrazol-1-ylphenyl)methyl]azanium Openeye Name: methyl-[[3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl]-[(3-pyrazol-1-ylphenyl)methyl]ammonium CAS Name: methyl-[[3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl]-[[3-(1-pyrazolyl)phenyl]methyl]ammonium IUPAC Name: methyl-[[3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl]-[(3-pyrazol-1-ylphenyl)methyl]azanium Traditional Name: [3-(4-keto-6-methyl-1H-pyrimidin-2-yl)benzyl]-methyl-(3-pyrazol-1-ylbenzyl)ammonium Formula: C23H24N5O+ MolecularWeight: 386.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)C[NH+](C)CC3=CC(=CC=C3)N4C=CC=N4

Isomeric SMILES

CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)C[NH+](C)CC3=CC(=CC=C3)N4C=CC=N4

InChI

InChI=1S/C23H23N5O/c1-17-12-22(29)26-23(25-17)20-8-3-6-18(13-20)15-27(2)16-19-7-4-9-21(14-19)28-11-5-10-24-28/h3-14H,15-16H2,1-2H3,(H,25,26,29)/p+1