2-[5-nitro-1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]sulfanylpropanamide

Systemtic Name: 2-[5-nitro-1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]sulfanylpropanamide Openeye Name: 2-[5-nitro-1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]sulfanylpropanamide CAS Name: 2-[[5-nitro-1-[3-(trifluoromethyl)phenyl]-2-benzimidazolyl]thio]propanamide IUPAC Name: 2-[5-nitro-1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]sulfanylpropanamide Traditional Name: 2-[[5-nitro-1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]thio]propionamide Formula: C17H13F3N4O3S MolecularWeight: 410.37033

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)SC1=NC2=C(N1C3=CC=CC(=C3)C(F)(F)F)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N)SC1=NC2=C(N1C3=CC=CC(=C3)C(F)(F)F)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H13F3N4O3S/c1-9(15(21)25)28-16-22-13-8-12(24(26)27)5-6-14(13)23(16)11-4-2-3-10(7-11)17(18,19)20/h2-9H,1H3,(H2,21,25)