2-bromanyl-N-[(4-fluoranyl-3-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[(4-fluoranyl-3-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[(4-fluoro-3-nitro-phenyl)carbamothioyl]benzamide CAS Name: 2-bromo-N-[(4-fluoro-3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[(4-fluoro-3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 2-bromo-N-[(4-fluoro-3-nitro-phenyl)thiocarbamoyl]benzamide Formula: C14H9BrFN3O3S MolecularWeight: 398.206963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9BrFN3O3S/c15-10-4-2-1-3-9(10)13(20)18-14(23)17-8-5-6-11(16)12(7-8)19(21)22/h1-7H,(H2,17,18,20,23)