1-methyl-3,5-bis(methylsulfanyl)-1,2,4-triazin-1-ium iodide

Systemtic Name: 1-methyl-3,5-bis(methylsulfanyl)-1,2,4-triazin-1-ium iodide Openeye Name: 1-methyl-3,5-bis(methylsulfanyl)-1,2,4-triazin-1-ium iodide CAS Name: 1-methyl-3,5-bis(methylthio)-1,2,4-triazin-1-ium iodide IUPAC Name: 1-methyl-3,5-bis(methylsulfanyl)-1,2,4-triazin-1-ium iodide Traditional Name: 1-methyl-3,5-bis(methylthio)-1,2,4-triazin-1-ium iodide Formula: C6H10IN3S2 MolecularWeight: 315.19817

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NC(=NC(=C1)SC)SC.[I-]

Isomeric SMILES

C[N+]1=NC(=NC(=C1)SC)SC.[I-]

InChI

InChI=1S/C6H10N3S2.HI/c1-9-4-5(10-2)7-6(8-9)11-3;/h4H,1-3H3;1H/q+1;/p-1