3-[[6-(4-ethanoyl-5-methyl-pyrazol-1-yl)pyrimidin-4-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[6-(4-ethanoyl-5-methyl-pyrazol-1-yl)pyrimidin-4-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[6-(4-acetyl-5-methyl-pyrazol-1-yl)pyrimidin-4-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[6-(4-acetyl-5-methyl-1-pyrazolyl)-4-pyrimidinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[6-(4-acetyl-5-methylpyrazol-1-yl)pyrimidin-4-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[6-(4-acetyl-5-methyl-pyrazol-1-yl)pyrimidin-4-yl]amino]propyl-dimethyl-ammonium Formula: C15H23N6O+ MolecularWeight: 303.38272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC(=NC=N2)NCCC[NH+](C)C)C(=O)C

Isomeric SMILES

CC1=C(C=NN1C2=CC(=NC=N2)NCCC[NH+](C)C)C(=O)C

InChI

InChI=1S/C15H22N6O/c1-11-13(12(2)22)9-19-21(11)15-8-14(17-10-18-15)16-6-5-7-20(3)4/h8-10H,5-7H2,1-4H3,(H,16,17,18)/p+1