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

Systemtic Name: N-[[2-(2-methoxyphenoxy)ethanoylamino]carbamothioyl]-4-nitro-benzamide Openeye Name: N-[[[2-(2-methoxyphenoxy)acetyl]amino]carbamothioyl]-4-nitro-benzamide CAS Name: N-[[[2-(2-methoxyphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[[[2-(2-methoxyphenoxy)acetyl]amino]carbamothioyl]-4-nitrobenzamide Traditional Name: N-[[[2-(2-methoxyphenoxy)acetyl]amino]thiocarbamoyl]-4-nitro-benzamide Formula: C17H16N4O6S MolecularWeight: 404.39714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O6S/c1-26-13-4-2-3-5-14(13)27-10-15(22)19-20-17(28)18-16(23)11-6-8-12(9-7-11)21(24)25/h2-9H,10H2,1H3,(H,19,22)(H2,18,20,23,28)