4-nitro-N-[(2-phenoxyethanoylamino)carbamothioyl]benzamide

Systemtic Name: 4-nitro-N-[(2-phenoxyethanoylamino)carbamothioyl]benzamide Openeye Name: 4-nitro-N-[[(2-phenoxyacetyl)amino]carbamothioyl]benzamide CAS Name: 4-nitro-N-[[(1-oxo-2-phenoxyethyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-nitro-N-[[(2-phenoxyacetyl)amino]carbamothioyl]benzamide Traditional Name: 4-nitro-N-[[(2-phenoxyacetyl)amino]thiocarbamoyl]benzamide Formula: C16H14N4O5S MolecularWeight: 374.37116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O5S/c21-14(10-25-13-4-2-1-3-5-13)18-19-16(26)17-15(22)11-6-8-12(9-7-11)20(23)24/h1-9H,10H2,(H,18,21)(H2,17,19,22,26)