(E)-aminocarbonyl-[[(4-fluorophenyl)amino]-methylsulfanyloxy-methylidene]azanium iodide

Systemtic Name: (E)-aminocarbonyl-[[(4-fluorophenyl)amino]-methylsulfanyloxy-methylidene]azanium iodide Openeye Name: (E)-carbamoyl-[(4-fluoroanilino)-methylsulfanyloxy-methylene]ammonium iodide CAS Name: (E)-carbamoyl-[(4-fluoroanilino)-(methylthio)oxymethylidene]ammonium iodide IUPAC Name: (E)-carbamoyl-[(4-fluoroanilino)-methylsulfanyloxymethylidene]azanium iodide Traditional Name: (E)-carbamoyl-[(4-fluoroanilino)-(methylthio)oxy-methylene]ammonium iodide Formula: C9H11FIN3O2S MolecularWeight: 371.170413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSOC(=[NH+]C(=O)N)NC1=CC=C(C=C1)F.[I-]

Isomeric SMILES

CSO/C(=[NH+]/C(=O)N)/NC1=CC=C(C=C1)F.[I-]

InChI

InChI=1S/C9H10FN3O2S.HI/c1-16-15-9(13-8(11)14)12-7-4-2-6(10)3-5-7;/h2-5H,1H3,(H3,11,12,13,14);1H