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

Systemtic Name: N-[(3-nitrophenyl)carbamothioyl]furan-2-carboxamide Openeye Name: N-[(3-nitrophenyl)carbamothioyl]furan-2-carboxamide CAS Name: N-[(3-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[(3-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: N-[(3-nitrophenyl)thiocarbamoyl]-2-furamide Formula: C12H9N3O4S MolecularWeight: 291.28256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=CO2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=CO2

InChI

InChI=1S/C12H9N3O4S/c16-11(10-5-2-6-19-10)14-12(20)13-8-3-1-4-9(7-8)15(17)18/h1-7H,(H2,13,14,16,20)