1,5-dimethyl-1H-pyrazol-1-ium; sulfuryl dichloride; chloride

Systemtic Name: 1,5-dimethyl-1H-pyrazol-1-ium; sulfuryl dichloride; chloride Openeye Name: 1,5-dimethyl-1H-pyrazol-1-ium; sulfuryl chloride; chloride CAS Name: 1,5-dimethyl-1H-pyrazol-1-ium; sulfuryl dichloride; chloride IUPAC Name: 1,5-dimethyl-1H-pyrazol-1-ium; sulfuryl dichloride; chloride Traditional Name: 1,5-dimethyl-1H-pyrazol-1-ium; sulfuryl chloride; chloride Formula: C5H9Cl3N2O2S MolecularWeight: 267.56116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=N[NH+]1C.O=S(=O)(Cl)Cl.[Cl-]

Isomeric SMILES

CC1=CC=N[NH+]1C.O=S(=O)(Cl)Cl.[Cl-]

InChI

InChI=1S/C5H8N2.Cl2O2S.ClH/c1-5-3-4-6-7(5)2;1-5(2,3)4;/h3-4H,1-2H3;;1H