3-[[2-fluoranyl-4-(trifluoromethyl)phenyl]carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[2-fluoranyl-4-(trifluoromethyl)phenyl]carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[[2-fluoro-4-(trifluoromethyl)benzoyl]-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[[2-fluoro-4-(trifluoromethyl)phenyl]-oxomethyl]-methylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[[2-fluoro-4-(trifluoromethyl)benzoyl]-methylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[[2-fluoro-4-(trifluoromethyl)benzoyl]-methyl-amino]-5-phenyl-2-thenoic acid Formula: C20H13F4NO3S MolecularWeight: 423.380733

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)C(F)(F)F)F

Isomeric SMILES

CN(C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)C(F)(F)F)F

InChI

InChI=1S/C20H13F4NO3S/c1-25(18(26)13-8-7-12(9-14(13)21)20(22,23)24)15-10-16(29-17(15)19(27)28)11-5-3-2-4-6-11/h2-10H,1H3,(H,27,28)