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

Systemtic Name: methyl 2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: methyl 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]acetic acid methyl ester Formula: C18H15F3N2O2S MolecularWeight: 380.38411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15F3N2O2S/c1-25-16(24)11-26-17-22-14-9-13(18(19,20)21)7-8-15(14)23(17)10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3