4-nitro-N-[[2-(2-phenylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-nitro-N-[[2-(2-phenylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-nitro-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-nitro-N-[[[1-oxo-2-(2-phenylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-nitro-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-nitro-N-[[[2-(2-phenylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C22H18N4O5S MolecularWeight: 450.46712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2OCC(=O)NNC(=S)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2OCC(=O)NNC(=S)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O5S/c27-20(14-31-19-9-5-4-8-18(19)15-6-2-1-3-7-15)24-25-22(32)23-21(28)16-10-12-17(13-11-16)26(29)30/h1-13H,14H2,(H,24,27)(H2,23,25,28,32)