methyl-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]-[(1S)-1-pyrimidin-4-ylethyl]azanium

Systemtic Name: methyl-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]-[(1S)-1-pyrimidin-4-ylethyl]azanium Openeye Name: methyl-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]-[(1S)-1-pyrimidin-4-ylethyl]ammonium CAS Name: methyl-[[5-(1-naphthalenyl)-1H-pyrazol-4-yl]methyl]-[(1S)-1-(4-pyrimidinyl)ethyl]ammonium IUPAC Name: methyl-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]-[(1S)-1-pyrimidin-4-ylethyl]azanium Traditional Name: methyl-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]-[(1S)-1-(4-pyrimidyl)ethyl]ammonium Formula: C21H22N5+ MolecularWeight: 344.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=NC=C1)[NH+](C)CC2=C(NN=C2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C1=NC=NC=C1)[NH+](C)CC2=C(NN=C2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H21N5/c1-15(20-10-11-22-14-23-20)26(2)13-17-12-24-25-21(17)19-9-5-7-16-6-3-4-8-18(16)19/h3-12,14-15H,13H2,1-2H3,(H,24,25)/p+1/t15-/m0/s1