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methyl-(5-methylsulfanyl-1,2-dithiol-3-ylidene)-phenethyl-azanium iodide

methyl-(5-methylsulfanyl-1,2-dithiol-3-ylidene)-phenethyl-azanium iodide

Systemtic Name:methyl-(5-methylsulfanyl-1,2-dithiol-3-ylidene)-phenethyl-azanium iodide
Openeye Name:methyl-(5-methylsulfanyldithiol-3-ylidene)-phenethyl-ammonium iodide
CAS Name:methyl-[5-(methylthio)-3-dithiolylidene]-phenethylammonium iodide
IUPAC Name:methyl-(5-methylsulfanyldithiol-3-ylidene)-phenethylazanium iodide
Traditional Name:methyl-[5-(methylthio)dithiol-3-ylidene]-phenethyl-ammonium iodide
Formula: C13H16INS3
MolecularWeight: 409.37231
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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1C=C(SS1)SC)CCC2=CC=CC=C2.[I-]


Isomeric SMILES

C[N+](=C1C=C(SS1)SC)CCC2=CC=CC=C2.[I-]


InChI

InChI=1S/C13H16NS3.HI/c1-14(12-10-13(15-2)17-16-12)9-8-11-6-4-3-5-7-11;/h3-7,10H,8-9H2,1-2H3;1H/q+1;/p-1


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