2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpyridine-4-carboxylate

Systemtic Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpyridine-4-carboxylate Openeye Name: 2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]pyridine-4-carboxylate CAS Name: 2-[[5-(trifluoromethyl)-2-pyridinyl]thio]-4-pyridinecarboxylate IUPAC Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpyridine-4-carboxylate Traditional Name: 2-[[5-(trifluoromethyl)-2-pyridyl]thio]isonicotinate Formula: C12H6F3N2O2S- MolecularWeight: 299.24845

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(F)(F)F)SC2=NC=CC(=C2)C(=O)[O-]

Isomeric SMILES

C1=CC(=NC=C1C(F)(F)F)SC2=NC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C12H7F3N2O2S/c13-12(14,15)8-1-2-9(17-6-8)20-10-5-7(11(18)19)3-4-16-10/h1-6H,(H,18,19)/p-1