S-(6-nitro-1H-benzimidazol-2-yl) 2,2,2-tris(fluoranyl)ethanethioate

Systemtic Name: S-(6-nitro-1H-benzimidazol-2-yl) 2,2,2-tris(fluoranyl)ethanethioate Openeye Name: S-(6-nitro-1H-benzimidazol-2-yl) 2,2,2-trifluoroethanethioate CAS Name: 2,2,2-trifluoroethanethioic acid S-(6-nitro-1H-benzimidazol-2-yl) ester IUPAC Name: S-(6-nitro-1H-benzimidazol-2-yl) 2,2,2-trifluoroethanethioate Traditional Name: 2,2,2-trifluoroethanethioic acid S-(6-nitro-1H-benzimidazol-2-yl) ester Formula: C9H4F3N3O3S MolecularWeight: 291.20657

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)SC(=O)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)SC(=O)C(F)(F)F

InChI

InChI=1S/C9H4F3N3O3S/c10-9(11,12)7(16)19-8-13-5-2-1-4(15(17)18)3-6(5)14-8/h1-3H,(H,13,14)