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

Systemtic Name: 5-(3-nitrophenyl)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3-nitrophenyl)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(3-nitrophenyl)-N-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]-2-furancarboxamide IUPAC Name: 5-(3-nitrophenyl)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3-nitrophenyl)-N-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]-2-furamide Formula: C19H12F3N3O4S MolecularWeight: 435.37649

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H12F3N3O4S/c20-19(21,22)12-4-2-5-13(10-12)23-18(30)24-17(26)16-8-7-15(29-16)11-3-1-6-14(9-11)25(27)28/h1-10H,(H2,23,24,26,30)