N-[[2-fluoranyl-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[[2-fluoranyl-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[[2-fluoro-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide CAS Name: N-[[2-fluoro-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[[2-fluoro-5-(trifluoromethyl)phenyl]carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[[2-fluoro-5-(trifluoromethyl)phenyl]thiocarbamoyl]nicotinamide Formula: C14H9F4N3OS MolecularWeight: 343.299373

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)F

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)F

InChI

InChI=1S/C14H9F4N3OS/c15-10-4-3-9(14(16,17)18)6-11(10)20-13(23)21-12(22)8-2-1-5-19-7-8/h1-7H,(H2,20,21,22,23)