methyl N'-(phenylmethyl)carbamimidothioate hydroiodide

Systemtic Name: methyl N'-(phenylmethyl)carbamimidothioate hydroiodide Openeye Name: 3-benzyl-2-methyl-isothiourea hydroiodide CAS Name: N'-(phenylmethyl)carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-benzylcarbamimidothioate hydroiodide Traditional Name: 3-benzyl-2-methyl-isothiourea hydroiodide Formula: C9H13IN2S MolecularWeight: 308.18239

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC1=CC=CC=C1)N.I

Isomeric SMILES

CSC(=NCC1=CC=CC=C1)N.I

InChI

InChI=1S/C9H12N2S.HI/c1-12-9(10)11-7-8-5-3-2-4-6-8;/h2-6H,7H2,1H3,(H2,10,11);1H