3-[[4-fluoranyl-2-(trifluoromethyl)phenyl]sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[4-fluoranyl-2-(trifluoromethyl)phenyl]sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfonylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfonylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfonylamino]-5-phenyl-2-thenoic acid Formula: C18H11F4NO4S2 MolecularWeight: 445.407853

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NS(=O)(=O)C3=C(C=C(C=C3)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NS(=O)(=O)C3=C(C=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C18H11F4NO4S2/c19-11-6-7-15(12(8-11)18(20,21)22)29(26,27)23-13-9-14(28-16(13)17(24)25)10-4-2-1-3-5-10/h1-9,23H,(H,24,25)