5-nitro-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-nitro-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-nitro-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-nitro-N-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]-2-furancarboxamide IUPAC Name: 5-nitro-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-nitro-N-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]-2-furamide Formula: C13H8F3N3O4S MolecularWeight: 359.28053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H8F3N3O4S/c14-13(15,16)7-2-1-3-8(6-7)17-12(24)18-11(20)9-4-5-10(23-9)19(21)22/h1-6H,(H2,17,18,20,24)