methyl N-(2,6-dimethylphenyl)-N'-(2-methyl-1-oxidanyl-propan-2-yl)carbamimidothioate hydroiodide

Systemtic Name: methyl N-(2,6-dimethylphenyl)-N'-(2-methyl-1-oxidanyl-propan-2-yl)carbamimidothioate hydroiodide Openeye Name: 1-(2,6-dimethylphenyl)-3-(2-hydroxy-1,1-dimethyl-ethyl)-2-methyl-isothiourea hydroiodide CAS Name: N-(2,6-dimethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N-(2,6-dimethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)carbamimidothioate hydroiodide Traditional Name: 1-(2,6-dimethylphenyl)-3-(2-hydroxy-1,1-dimethyl-ethyl)-2-methyl-isothiourea hydroiodide Formula: C14H23IN2OS MolecularWeight: 394.31469

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=NC(C)(C)CO)SC.I

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=NC(C)(C)CO)SC.I

InChI

InChI=1S/C14H22N2OS.HI/c1-10-7-6-8-11(2)12(10)15-13(18-5)16-14(3,4)9-17;/h6-8,17H,9H2,1-5H3,(H,15,16);1H