3-[[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazol-5-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazol-5-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-1,2,4-oxadiazol-5-yl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carbonyl]amino]propyl-dimethyl-ammonium Formula: C14H22BrN6O2+ MolecularWeight: 386.26748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NOC(=N2)C(=O)NCCC[NH+](C)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=NOC(=N2)C(=O)NCCC[NH+](C)C)C)Br

InChI

InChI=1S/C14H21BrN6O2/c1-9-12(15)10(2)21(18-9)8-11-17-14(23-19-11)13(22)16-6-5-7-20(3)4/h5-8H2,1-4H3,(H,16,22)/p+1