[[(3-chloranyl-4-fluoranyl-phenyl)amino]-methylsulfanyl-methylidene]-phenyl-azanium iodide

Systemtic Name: [[(3-chloranyl-4-fluoranyl-phenyl)amino]-methylsulfanyl-methylidene]-phenyl-azanium iodide Openeye Name: [(3-chloro-4-fluoro-anilino)-methylsulfanyl-methylene]-phenyl-ammonium iodide CAS Name: [(3-chloro-4-fluoroanilino)-(methylthio)methylidene]-phenylammonium iodide IUPAC Name: [(3-chloro-4-fluoroanilino)-methylsulfanylmethylidene]-phenylazanium iodide Traditional Name: [(3-chloro-4-fluoro-anilino)-(methylthio)methylene]-phenyl-ammonium iodide Formula: C14H13ClFIN2S MolecularWeight: 422.687293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=[NH+]C1=CC=CC=C1)NC2=CC(=C(C=C2)F)Cl.[I-]

Isomeric SMILES

CSC(=[NH+]C1=CC=CC=C1)NC2=CC(=C(C=C2)F)Cl.[I-]

InChI

InChI=1S/C14H12ClFN2S.HI/c1-19-14(17-10-5-3-2-4-6-10)18-11-7-8-13(16)12(15)9-11;/h2-9H,1H3,(H,17,18);1H