5-methyl-2-methylsulfanyl-1-phenyl-pyrimidin-1-ium iodide

Systemtic Name: 5-methyl-2-methylsulfanyl-1-phenyl-pyrimidin-1-ium iodide Openeye Name: 5-methyl-2-methylsulfanyl-1-phenyl-pyrimidin-1-ium iodide CAS Name: 5-methyl-2-(methylthio)-1-phenylpyrimidin-1-ium iodide IUPAC Name: 5-methyl-2-methylsulfanyl-1-phenylpyrimidin-1-ium iodide Traditional Name: 5-methyl-2-(methylthio)-1-phenyl-pyrimidin-1-ium iodide Formula: C12H13IN2S MolecularWeight: 344.21449

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C([N+](=C1)C2=CC=CC=C2)SC.[I-]

Isomeric SMILES

CC1=CN=C([N+](=C1)C2=CC=CC=C2)SC.[I-]

InChI

InChI=1S/C12H13N2S.HI/c1-10-8-13-12(15-2)14(9-10)11-6-4-3-5-7-11;/h3-9H,1-2H3;1H/q+1;/p-1