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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

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