5-methylsulfanyl-3-phenyl-1,3,4-thiadiazol-3-ium iodide

Systemtic Name: 5-methylsulfanyl-3-phenyl-1,3,4-thiadiazol-3-ium iodide Openeye Name: 5-methylsulfanyl-3-phenyl-1,3,4-thiadiazol-3-ium iodide CAS Name: 5-(methylthio)-3-phenyl-1,3,4-thiadiazol-3-ium iodide IUPAC Name: 5-methylsulfanyl-3-phenyl-1,3,4-thiadiazol-3-ium iodide Traditional Name: 5-(methylthio)-3-phenyl-1,3,4-thiadiazol-3-ium iodide Formula: C9H9IN2S2 MolecularWeight: 336.21563

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=N[N+](=CS1)C2=CC=CC=C2.[I-]

Isomeric SMILES

CSC1=N[N+](=CS1)C2=CC=CC=C2.[I-]

InChI

InChI=1S/C9H9N2S2.HI/c1-12-9-10-11(7-13-9)8-5-3-2-4-6-8;/h2-7H,1H3;1H/q+1;/p-1