5-chloranyl-6-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: 5-chloranyl-6-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-pyridine-3-carboxylate Openeye Name: 5-chloro-6-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]pyridine-3-carboxylate CAS Name: 5-chloro-6-[[5-(trifluoromethyl)-2-pyridinyl]thio]-3-pyridinecarboxylate IUPAC Name: 5-chloro-6-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpyridine-3-carboxylate Traditional Name: 5-chloro-6-[[5-(trifluoromethyl)-2-pyridyl]thio]nicotinate Formula: C12H5ClF3N2O2S- MolecularWeight: 333.69351

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(F)(F)F)SC2=C(C=C(C=N2)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=NC=C1C(F)(F)F)SC2=C(C=C(C=N2)C(=O)[O-])Cl

InChI

InChI=1S/C12H6ClF3N2O2S/c13-8-3-6(11(19)20)4-18-10(8)21-9-2-1-7(5-17-9)12(14,15)16/h1-5H,(H,19,20)/p-1