N-[[2-nitro-4-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[[2-nitro-4-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[2-nitro-4-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: N-[[2-nitro-4-(trifluoromethyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[[2-nitro-4-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[2-nitro-4-(trifluoromethyl)phenyl]thiocarbamoyl]-2-furamide Formula: C13H8F3N3O4S MolecularWeight: 359.28053

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

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