2,4-bis(chloranyl)-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[[[2-(4-nitrophenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C16H12Cl2N4O5S MolecularWeight: 443.26128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12Cl2N4O5S/c17-9-1-6-12(13(18)7-9)15(24)19-16(28)21-20-14(23)8-27-11-4-2-10(3-5-11)22(25)26/h1-7H,8H2,(H,20,23)(H2,19,21,24,28)