methyl N'-cyclohexyl-N-phenyl-carbamimidothioate hydroiodide

Systemtic Name: methyl N'-cyclohexyl-N-phenyl-carbamimidothioate hydroiodide Openeye Name: 3-cyclohexyl-2-methyl-1-phenyl-isothiourea hydroiodide CAS Name: N'-cyclohexyl-N-phenylcarbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-cyclohexyl-N-phenylcarbamimidothioate hydroiodide Traditional Name: 3-cyclohexyl-2-methyl-1-phenyl-isothiourea hydroiodide Formula: C14H21IN2S MolecularWeight: 376.29941

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1CCCCC1)NC2=CC=CC=C2.I

Isomeric SMILES

CSC(=NC1CCCCC1)NC2=CC=CC=C2.I

InChI

InChI=1S/C14H20N2S.HI/c1-17-14(15-12-8-4-2-5-9-12)16-13-10-6-3-7-11-13;/h2,4-5,8-9,13H,3,6-7,10-11H2,1H3,(H,15,16);1H