5-bromanyl-N-[(2-chloranyl-4-nitro-phenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(2-chloranyl-4-nitro-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(2-chloro-4-nitro-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(2-chloro-4-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(2-chloro-4-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(2-chloro-4-nitro-phenyl)thiocarbamoyl]-2-furamide Formula: C12H7BrClN3O4S MolecularWeight: 404.62368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7BrClN3O4S/c13-10-4-3-9(21-10)11(18)16-12(22)15-8-2-1-6(17(19)20)5-7(8)14/h1-5H,(H2,15,16,18,22)