2-(4-chloranylphenoxy)-N-[[2-(2-nitrophenoxy)ethanoylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[[2-(2-nitrophenoxy)ethanoylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[[[2-(2-nitrophenoxy)acetyl]amino]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[[[2-(2-nitrophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[[[2-(2-nitrophenoxy)acetyl]amino]carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[[[2-(2-nitrophenoxy)acetyl]amino]thiocarbamoyl]acetamide Formula: C17H15ClN4O6S MolecularWeight: 438.8422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15ClN4O6S/c18-11-5-7-12(8-6-11)27-9-15(23)19-17(29)21-20-16(24)10-28-14-4-2-1-3-13(14)22(25)26/h1-8H,9-10H2,(H,20,24)(H2,19,21,23,29)