propan-2-yl 2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]acetic acid isopropyl ester Formula: C20H19F3N2O2S MolecularWeight: 408.43727

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19F3N2O2S/c1-13(2)27-18(26)12-28-19-24-16-10-15(20(21,22)23)8-9-17(16)25(19)11-14-6-4-3-5-7-14/h3-10,13H,11-12H2,1-2H3