methyl N-(2,4-dimethylphenyl)-N'-methyl-carbamimidothioate iodide

Systemtic Name: methyl N-(2,4-dimethylphenyl)-N'-methyl-carbamimidothioate iodide Openeye Name: 1-(2,4-dimethylphenyl)-2,3-dimethyl-isothiourea iodide CAS Name: N-(2,4-dimethylphenyl)-N'-methylcarbamimidothioic acid methyl ester iodide IUPAC Name: methyl N-(2,4-dimethylphenyl)-N'-methylcarbamimidothioate iodide Traditional Name: 1-(2,4-dimethylphenyl)-2,3-dimethyl-isothiourea iodide Formula: C11H16IN2S- MolecularWeight: 335.22761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=NC)SC)C.[I-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=NC)SC)C.[I-]

InChI

InChI=1S/C11H16N2S.HI/c1-8-5-6-10(9(2)7-8)13-11(12-3)14-4;/h5-7H,1-4H3,(H,12,13);1H/p-1