3-[(3-azanyl-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]propyl-trimethyl-azanium; methyl sulfate

Systemtic Name: 3-[(3-azanyl-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]propyl-trimethyl-azanium; methyl sulfate Openeye Name: 3-[(3-amino-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]propyl-trimethyl-ammonium; methyl sulfate CAS Name: 3-[(3-amino-5-methyl-7-pyrazolo[1,5-a]pyrimidinyl)amino]propyl-trimethylammonium; methyl sulfate IUPAC Name: 3-[(3-amino-5-methylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propyl-trimethylazanium; methyl sulfate Traditional Name: 3-[(3-amino-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]propyl-trimethyl-ammonium; methyl sulfate Formula: C14H26N6O4S MolecularWeight: 374.45904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(=C1)NCCC[N+](C)(C)C)N.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=NN2C(=C1)NCCC[N+](C)(C)C)N.COS(=O)(=O)[O-]

InChI

InChI=1S/C13H23N6.CH4O4S/c1-10-8-12(15-6-5-7-19(2,3)4)18-13(17-10)11(14)9-16-18;1-5-6(2,3)4/h8-9,15H,5-7,14H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1