5-(4,6-dimethylpyrimidin-2-yl)sulfanylpentyl-triethyl-azanium bromide

Systemtic Name: 5-(4,6-dimethylpyrimidin-2-yl)sulfanylpentyl-triethyl-azanium bromide Openeye Name: 5-(4,6-dimethylpyrimidin-2-yl)sulfanylpentyl-triethyl-ammonium bromide CAS Name: 5-[(4,6-dimethyl-2-pyrimidinyl)thio]pentyl-triethylammonium bromide IUPAC Name: 5-(4,6-dimethylpyrimidin-2-yl)sulfanylpentyl-triethylazanium bromide Traditional Name: 5-[(4,6-dimethylpyrimidin-2-yl)thio]pentyl-triethyl-ammonium bromide Formula: C17H32BrN3S MolecularWeight: 390.42508

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCCCCSC1=NC(=CC(=N1)C)C.[Br-]

Isomeric SMILES

CC[N+](CC)(CC)CCCCCSC1=NC(=CC(=N1)C)C.[Br-]

InChI

InChI=1S/C17H32N3S.BrH/c1-6-20(7-2,8-3)12-10-9-11-13-21-17-18-15(4)14-16(5)19-17;/h14H,6-13H2,1-5H3;1H/q+1;/p-1