methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]-[[4-(4-oxidanylidene-6-pyridin-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]azanium

Systemtic Name: methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]-[[4-(4-oxidanylidene-6-pyridin-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]azanium Openeye Name: methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]-[[4-[4-oxo-6-(2-pyridyl)-1H-pyrimidin-2-yl]phenyl]methyl]ammonium CAS Name: methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]-[[4-[4-oxo-6-(2-pyridinyl)-1H-pyrimidin-2-yl]phenyl]methyl]ammonium IUPAC Name: methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]-[[4-(4-oxo-6-pyridin-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]azanium Traditional Name: [4-[4-keto-6-(2-pyridyl)-1H-pyrimidin-2-yl]benzyl]-methyl-[(5-methyl-1H-pyrazol-3-yl)methyl]ammonium Formula: C22H23N6O+ MolecularWeight: 387.45762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C[NH+](C)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC(=NN1)C[NH+](C)CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)C4=CC=CC=N4

InChI

InChI=1S/C22H22N6O/c1-15-11-18(27-26-15)14-28(2)13-16-6-8-17(9-7-16)22-24-20(12-21(29)25-22)19-5-3-4-10-23-19/h3-12H,13-14H2,1-2H3,(H,26,27)(H,24,25,29)/p+1