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

Systemtic Name: 5-bromanyl-N-[(3-nitrophenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(3-nitrophenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(3-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(3-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(3-nitrophenyl)thiocarbamoyl]-2-furamide Formula: C12H8BrN3O4S MolecularWeight: 370.17862

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=C(O2)Br

Isomeric SMILES

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

InChI

InChI=1S/C12H8BrN3O4S/c13-10-5-4-9(20-10)11(17)15-12(21)14-7-2-1-3-8(6-7)16(18)19/h1-6H,(H2,14,15,17,21)