3-phenyl-1H-imidazol-3-ium-2-thiol chloride

Systemtic Name: 3-phenyl-1H-imidazol-3-ium-2-thiol chloride Openeye Name: 3-phenyl-1H-imidazol-3-ium-2-thiol chloride CAS Name: 3-phenyl-1H-imidazol-3-ium-2-thiol chloride IUPAC Name: 3-phenyl-1H-imidazol-3-ium-2-thiol chloride Traditional Name: 3-phenyl-1H-imidazol-3-ium-2-thiol chloride Formula: C9H9ClN2S MolecularWeight: 212.69916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(NC=C2)S.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(NC=C2)S.[Cl-]

InChI

InChI=1S/C9H8N2S.ClH/c12-9-10-6-7-11(9)8-4-2-1-3-5-8;/h1-7H,(H,10,12);1H