N-(4-bromanyl-2-fluoranyl-phenyl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanamide Openeye Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(4-bromo-2-fluoro-phenyl)acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[2-(phenylmethylthio)-1-benzimidazolyl]acetamide IUPAC Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(4-bromo-2-fluorophenyl)acetamide Traditional Name: 2-[2-(benzylthio)benzimidazol-1-yl]-N-(4-bromo-2-fluoro-phenyl)acetamide Formula: C22H17BrFN3OS MolecularWeight: 470.357283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2CC(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2CC(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C22H17BrFN3OS/c23-16-10-11-18(17(24)12-16)25-21(28)13-27-20-9-5-4-8-19(20)26-22(27)29-14-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,25,28)