(2E)-2-[1,3-diethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-ylidene]-N-phenyl-ethanimine hydroiodide

Systemtic Name: (2E)-2-[1,3-diethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-ylidene]-N-phenyl-ethanimine hydroiodide Openeye Name: (2E)-2-[1,3-diethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-ylidene]-N-phenyl-ethanimine hydroiodide CAS Name: (2E)-2-[1,3-diethyl-5-(trifluoromethylsulfonyl)-2-benzimidazolylidene]-N-phenylethanimine hydroiodide IUPAC Name: (2E)-2-[1,3-diethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-ylidene]-N-phenylethanimine hydroiodide Traditional Name: [(2E)-2-(1,3-diethyl-5-triflyl-benzimidazol-2-ylidene)ethylidene]-phenyl-amine hydroiodide Formula: C20H21F3IN3O2S MolecularWeight: 551.36432

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)N(C1=CC=NC3=CC=CC=C3)CC.I

Isomeric SMILES

CCN\1C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)N(/C1=C/C=NC3=CC=CC=C3)CC.I

InChI

InChI=1S/C20H20F3N3O2S.HI/c1-3-25-17-11-10-16(29(27,28)20(21,22)23)14-18(17)26(4-2)19(25)12-13-24-15-8-6-5-7-9-15;/h5-14H,3-4H2,1-2H3;1H/b19-12+,24-13?;