2-bromanyl-N-[(4-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[(4-nitrophenyl)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[(4-nitrophenyl)carbamothioyl]benzamide CAS Name: 2-bromo-N-[(4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[(4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 2-bromo-N-[(4-nitrophenyl)thiocarbamoyl]benzamide Formula: C14H10BrN3O3S MolecularWeight: 380.2165

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)[N+](=O)[O-])Br

Isomeric SMILES

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

InChI

InChI=1S/C14H10BrN3O3S/c15-12-4-2-1-3-11(12)13(19)17-14(22)16-9-5-7-10(8-6-9)18(20)21/h1-8H,(H2,16,17,19,22)