2-[2-oxidanylidene-2-[[4-(trifluoromethyl)phenyl]amino]ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-oxidanylidene-2-[[4-(trifluoromethyl)phenyl]amino]ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-keto-2-[4-(trifluoromethyl)anilino]ethyl]thio]nicotinic acid Formula: C15H11F3N2O3S MolecularWeight: 356.31965

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NC2=CC=C(C=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NC2=CC=C(C=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C15H11F3N2O3S/c16-15(17,18)9-3-5-10(6-4-9)20-12(21)8-24-13-11(14(22)23)2-1-7-19-13/h1-7H,8H2,(H,20,21)(H,22,23)