4-methyl-3-methylsulfanyl-5-phenyl-2H-1,4-thiazin-4-ium iodide

Systemtic Name: 4-methyl-3-methylsulfanyl-5-phenyl-2H-1,4-thiazin-4-ium iodide Openeye Name: 4-methyl-3-methylsulfanyl-5-phenyl-2H-1,4-thiazin-4-ium iodide CAS Name: 4-methyl-3-(methylthio)-5-phenyl-2H-1,4-thiazin-4-ium iodide IUPAC Name: 4-methyl-3-methylsulfanyl-5-phenyl-2H-1,4-thiazin-4-ium iodide Traditional Name: 4-methyl-3-(methylthio)-5-phenyl-2H-1,4-thiazin-4-ium iodide Formula: C12H14INS2 MolecularWeight: 363.28073

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(CSC=C1C2=CC=CC=C2)SC.[I-]

Isomeric SMILES

C[N+]1=C(CSC=C1C2=CC=CC=C2)SC.[I-]

InChI

InChI=1S/C12H14NS2.HI/c1-13-11(8-15-9-12(13)14-2)10-6-4-3-5-7-10;/h3-8H,9H2,1-2H3;1H/q+1;/p-1