methyl N-(4-methylphenyl)sulfonyl-N-(C-methylsulfanylcarbonimidoyl)sulfanyl-carbamimidothioate

Systemtic Name: methyl N-(4-methylphenyl)sulfonyl-N-(C-methylsulfanylcarbonimidoyl)sulfanyl-carbamimidothioate Openeye Name: 2-methyl-1-(methylsulfanylcarbonimidoyl)sulfanyl-1-(p-tolylsulfonyl)isothiourea CAS Name: N-[[imino-(methylthio)methyl]thio]-N-(4-methylphenyl)sulfonylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-methylphenyl)sulfonyl-N-(C-methylsulfanylcarbonimidoyl)sulfanylcarbamimidothioate Traditional Name: 2-methyl-1-[[(methylthio)carbonimidoyl]thio]-1-tosyl-isothiourea Formula: C11H15N3O2S4 MolecularWeight: 349.5157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C(=N)SC)SC(=N)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C(=N)SC)SC(=N)SC

InChI

InChI=1S/C11H15N3O2S4/c1-8-4-6-9(7-5-8)20(15,16)14(10(12)17-2)19-11(13)18-3/h4-7,12-13H,1-3H3