N-(3-acetamidophenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[[1-propyl-6-(trifluoromethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]thio]acetamide Formula: C21H21F3N4O2S MolecularWeight: 450.47725

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC(=O)NC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC(=O)NC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C21H21F3N4O2S/c1-3-9-28-18-10-14(21(22,23)24)7-8-17(18)27-20(28)31-12-19(30)26-16-6-4-5-15(11-16)25-13(2)29/h4-8,10-11H,3,9,12H2,1-2H3,(H,25,29)(H,26,30)