(2-butylsulfanyl-2-pyrazin-2-yloxy-ethyl)-trimethyl-azanium iodide

Systemtic Name: (2-butylsulfanyl-2-pyrazin-2-yloxy-ethyl)-trimethyl-azanium iodide Openeye Name: (2-butylsulfanyl-2-pyrazin-2-yloxy-ethyl)-trimethyl-ammonium iodide CAS Name: [2-(butylthio)-2-(2-pyrazinyloxy)ethyl]-trimethylammonium iodide IUPAC Name: (2-butylsulfanyl-2-pyrazin-2-yloxyethyl)-trimethylazanium iodide Traditional Name: [2-(butylthio)-2-pyrazin-2-yloxy-ethyl]-trimethyl-ammonium iodide Formula: C13H24IN3OS MolecularWeight: 397.31863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(C[N+](C)(C)C)OC1=NC=CN=C1.[I-]

Isomeric SMILES

CCCCSC(C[N+](C)(C)C)OC1=NC=CN=C1.[I-]

InChI

InChI=1S/C13H24N3OS.HI/c1-5-6-9-18-13(11-16(2,3)4)17-12-10-14-7-8-15-12;/h7-8,10,13H,5-6,9,11H2,1-4H3;1H/q+1;/p-1