2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-1-[3-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-1-[3-(trifluoromethyl)phenyl]ethanone Openeye Name: 2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-1-[3-(trifluoromethyl)phenyl]ethanone CAS Name: 2-[[1-(2-methoxyphenyl)-5-nitro-2-benzimidazolyl]thio]-1-[3-(trifluoromethyl)phenyl]ethanone IUPAC Name: 2-[1-(2-methoxyphenyl)-5-nitrobenzimidazol-2-yl]sulfanyl-1-[3-(trifluoromethyl)phenyl]ethanone Traditional Name: 2-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]thio]-1-[3-(trifluoromethyl)phenyl]ethanone Formula: C23H16F3N3O4S MolecularWeight: 487.45105

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H16F3N3O4S/c1-33-21-8-3-2-7-19(21)28-18-10-9-16(29(31)32)12-17(18)27-22(28)34-13-20(30)14-5-4-6-15(11-14)23(24,25)26/h2-12H,13H2,1H3