N-[2-[bis(fluoranyl)methoxy]phenyl]-2-(5-nitro-1-phenyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-[bis(fluoranyl)methoxy]phenyl]-2-(5-nitro-1-phenyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(difluoromethoxy)phenyl]-2-(5-nitro-1-phenyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[2-(difluoromethoxy)phenyl]-2-[(5-nitro-1-phenyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[2-(difluoromethoxy)phenyl]-2-(5-nitro-1-phenylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[2-(difluoromethoxy)phenyl]-2-[(5-nitro-1-phenyl-benzimidazol-2-yl)thio]acetamide Formula: C22H16F2N4O4S MolecularWeight: 470.448646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)NC4=CC=CC=C4OC(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)NC4=CC=CC=C4OC(F)F

InChI

InChI=1S/C22H16F2N4O4S/c23-21(24)32-19-9-5-4-8-16(19)25-20(29)13-33-22-26-17-12-15(28(30)31)10-11-18(17)27(22)14-6-2-1-3-7-14/h1-12,21H,13H2,(H,25,29)