N-cyclooctyl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclooctyl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-cyclooctyl-acetamide CAS Name: N-cyclooctyl-2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-cyclooctylacetamide Traditional Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-N-cyclooctyl-acetamide Formula: C25H28F3N3OS MolecularWeight: 475.56953

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C25H28F3N3OS/c26-25(27,28)19-13-14-22-21(15-19)30-24(31(22)16-18-9-5-4-6-10-18)33-17-23(32)29-20-11-7-2-1-3-8-12-20/h4-6,9-10,13-15,20H,1-3,7-8,11-12,16-17H2,(H,29,32)