methyl N'-methyl-N-(2,4,5-trimethylphenyl)carbamimidothioate hydroiodide

Systemtic Name: methyl N'-methyl-N-(2,4,5-trimethylphenyl)carbamimidothioate hydroiodide Openeye Name: 2,3-dimethyl-1-(2,4,5-trimethylphenyl)isothiourea hydroiodide CAS Name: N'-methyl-N-(2,4,5-trimethylphenyl)carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-methyl-N-(2,4,5-trimethylphenyl)carbamimidothioate hydroiodide Traditional Name: 2,3-dimethyl-1-(2,4,5-trimethylphenyl)isothiourea hydroiodide Formula: C12H19IN2S MolecularWeight: 350.26213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=NC)SC)C.I

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=NC)SC)C.I

InChI

InChI=1S/C12H18N2S.HI/c1-8-6-10(3)11(7-9(8)2)14-12(13-4)15-5;/h6-7H,1-5H3,(H,13,14);1H