2-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]amino]pyridine-4-carboxylate

Systemtic Name: 2-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]amino]pyridine-4-carboxylate Openeye Name: 2-[2-(difluoromethylsulfanyl)anilino]pyridine-4-carboxylate CAS Name: 2-[2-(difluoromethylthio)anilino]-4-pyridinecarboxylate IUPAC Name: 2-[2-(difluoromethylsulfanyl)anilino]pyridine-4-carboxylate Traditional Name: 2-[2-(difluoromethylthio)anilino]isonicotinate Formula: C13H9F2N2O2S- MolecularWeight: 295.284566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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