N-[[(4-acetamidophenyl)carbonylamino]carbamothioyl]-2-(1-bromanylnaphthalen-2-yl)oxy-ethanamide

Systemtic Name: N-[[(4-acetamidophenyl)carbonylamino]carbamothioyl]-2-(1-bromanylnaphthalen-2-yl)oxy-ethanamide Openeye Name: N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-2-[(1-bromo-2-naphthyl)oxy]acetamide CAS Name: N-[[[(4-acetamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-[(1-bromo-2-naphthalenyl)oxy]acetamide IUPAC Name: N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-2-(1-bromonaphthalen-2-yl)oxyacetamide Traditional Name: N-[[(4-acetamidobenzoyl)amino]thiocarbamoyl]-2-(1-bromo-2-naphthoxy)acetamide Formula: C22H19BrN4O4S MolecularWeight: 515.37966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C22H19BrN4O4S/c1-13(28)24-16-9-6-15(7-10-16)21(30)26-27-22(32)25-19(29)12-31-18-11-8-14-4-2-3-5-17(14)20(18)23/h2-11H,12H2,1H3,(H,24,28)(H,26,30)(H2,25,27,29,32)