N-(1,3-benzodioxol-5-yl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[1-propyl-6-(trifluoromethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]thio]acetamide Formula: C20H18F3N3O3S MolecularWeight: 437.43543

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18F3N3O3S/c1-2-7-26-15-8-12(20(21,22)23)3-5-14(15)25-19(26)30-10-18(27)24-13-4-6-16-17(9-13)29-11-28-16/h3-6,8-9H,2,7,10-11H2,1H3,(H,24,27)