5-bromanyl-2-methoxy-N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-N-[(2-hydroxy-4-nitro-phenyl)carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[(2-hydroxy-4-nitroanilino)-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[(2-hydroxy-4-nitro-phenyl)thiocarbamoyl]-2-methoxy-benzamide Formula: C15H12BrN3O5S MolecularWeight: 426.24188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C15H12BrN3O5S/c1-24-13-5-2-8(16)6-10(13)14(21)18-15(25)17-11-4-3-9(19(22)23)7-12(11)20/h2-7,20H,1H3,(H2,17,18,21,25)