methyl N'-[2-(4-methoxyphenyl)phenyl]carbamimidothioate hydroiodide

Systemtic Name: methyl N'-[2-(4-methoxyphenyl)phenyl]carbamimidothioate hydroiodide Openeye Name: 3-[2-(4-methoxyphenyl)phenyl]-2-methyl-isothiourea hydroiodide CAS Name: N'-[2-(4-methoxyphenyl)phenyl]carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-[2-(4-methoxyphenyl)phenyl]carbamimidothioate hydroiodide Traditional Name: 3-[2-(4-methoxyphenyl)phenyl]-2-methyl-isothiourea hydroiodide Formula: C15H17IN2OS MolecularWeight: 400.27775

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=CC=C2N=C(N)SC.I

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=CC=C2N=C(N)SC.I

InChI

InChI=1S/C15H16N2OS.HI/c1-18-12-9-7-11(8-10-12)13-5-3-4-6-14(13)17-15(16)19-2;/h3-10H,1-2H3,(H2,16,17);1H