methyl N-phenyl-N'-(1-phenylethyl)carbamimidothioate hydroiodide

Systemtic Name: methyl N-phenyl-N'-(1-phenylethyl)carbamimidothioate hydroiodide Openeye Name: 2-methyl-1-phenyl-3-(1-phenylethyl)isothiourea hydroiodide CAS Name: N-phenyl-N'-(1-phenylethyl)carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N-phenyl-N'-(1-phenylethyl)carbamimidothioate hydroiodide Traditional Name: 2-methyl-1-phenyl-3-(1-phenylethyl)isothiourea hydroiodide Formula: C16H19IN2S MolecularWeight: 398.30493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N=C(NC2=CC=CC=C2)SC.I

Isomeric SMILES

CC(C1=CC=CC=C1)N=C(NC2=CC=CC=C2)SC.I

InChI

InChI=1S/C16H18N2S.HI/c1-13(14-9-5-3-6-10-14)17-16(19-2)18-15-11-7-4-8-12-15;/h3-13H,1-2H3,(H,17,18);1H