N-pentan-3-yl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-pentan-3-yl-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-(1-ethylpropyl)acetamide CAS Name: N-pentan-3-yl-2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-N-pentan-3-ylacetamide Traditional Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-N-(1-ethylpropyl)acetamide Formula: C22H24F3N3OS MolecularWeight: 435.50567

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(F)(F)F

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C22H24F3N3OS/c1-3-17(4-2)26-20(29)14-30-21-27-18-12-16(22(23,24)25)10-11-19(18)28(21)13-15-8-6-5-7-9-15/h5-12,17H,3-4,13-14H2,1-2H3,(H,26,29)