2-methylsulfanyl-3-(phenylmethyl)-5,6-dihydro-4H-1,3-thiazin-3-ium iodide

Systemtic Name: 2-methylsulfanyl-3-(phenylmethyl)-5,6-dihydro-4H-1,3-thiazin-3-ium iodide Openeye Name: 3-benzyl-2-methylsulfanyl-5,6-dihydro-4H-1,3-thiazin-3-ium iodide CAS Name: 2-(methylthio)-3-(phenylmethyl)-5,6-dihydro-4H-1,3-thiazin-3-ium iodide IUPAC Name: 3-benzyl-2-methylsulfanyl-5,6-dihydro-4H-1,3-thiazin-3-ium iodide Traditional Name: 3-benzyl-2-(methylthio)-5,6-dihydro-4H-1,3-thiazin-3-ium iodide Formula: C12H16INS2 MolecularWeight: 365.29661

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=[N+](CCCS1)CC2=CC=CC=C2.[I-]

Isomeric SMILES

CSC1=[N+](CCCS1)CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C12H16NS2.HI/c1-14-12-13(8-5-9-15-12)10-11-6-3-2-4-7-11;/h2-4,6-7H,5,8-10H2,1H3;1H/q+1;/p-1