6-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]amino]pyridine-3-carboxylic acid Openeye Name: 6-[2-(difluoromethylsulfanyl)anilino]pyridine-3-carboxylic acid CAS Name: 6-[2-(difluoromethylthio)anilino]-3-pyridinecarboxylic acid IUPAC Name: 6-[2-(difluoromethylsulfanyl)anilino]pyridine-3-carboxylic acid Traditional Name: 6-[2-(difluoromethylthio)anilino]nicotinic acid Formula: C13H10F2N2O2S MolecularWeight: 296.292506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NC=C(C=C2)C(=O)O)SC(F)F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NC=C(C=C2)C(=O)O)SC(F)F

InChI

InChI=1S/C13H10F2N2O2S/c14-13(15)20-10-4-2-1-3-9(10)17-11-6-5-8(7-16-11)12(18)19/h1-7,13H,(H,16,17)(H,18,19)