methyl N'-(3-methoxypropyl)-N-(2,4,6-trimethylphenyl)carbamimidothioate hydroiodide

Systemtic Name: methyl N'-(3-methoxypropyl)-N-(2,4,6-trimethylphenyl)carbamimidothioate hydroiodide Openeye Name: 3-(3-methoxypropyl)-2-methyl-1-(2,4,6-trimethylphenyl)isothiourea hydroiodide CAS Name: N'-(3-methoxypropyl)-N-(2,4,6-trimethylphenyl)carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-(3-methoxypropyl)-N-(2,4,6-trimethylphenyl)carbamimidothioate hydroiodide Traditional Name: 1-mesityl-3-(3-methoxypropyl)-2-methyl-isothiourea hydroiodide Formula: C15H25IN2OS MolecularWeight: 408.34127

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2OS.HI/c1-11-9-12(2)14(13(3)10-11)17-15(19-5)16-7-6-8-18-4;/h9-10H,6-8H2,1-5H3,(H,16,17);1H