ethyl N'-(4-phenylmethoxyphenyl)carbamimidothioate hydroiodide

Systemtic Name: ethyl N'-(4-phenylmethoxyphenyl)carbamimidothioate hydroiodide Openeye Name: 3-(4-benzyloxyphenyl)-2-ethyl-isothiourea hydroiodide CAS Name: N'-(4-phenylmethoxyphenyl)carbamimidothioic acid ethyl ester hydroiodide IUPAC Name: ethyl N'-(4-phenylmethoxyphenyl)carbamimidothioate hydroiodide Traditional Name: 3-(4-benzoxyphenyl)-2-ethyl-isothiourea hydroiodide Formula: C16H19IN2OS MolecularWeight: 414.30433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=CC=C(C=C1)OCC2=CC=CC=C2)N.I

Isomeric SMILES

CCSC(=NC1=CC=C(C=C1)OCC2=CC=CC=C2)N.I

InChI

InChI=1S/C16H18N2OS.HI/c1-2-20-16(17)18-14-8-10-15(11-9-14)19-12-13-6-4-3-5-7-13;/h3-11H,2,12H2,1H3,(H2,17,18);1H