4-chloranyl-3-nitro-N-[[2-(2-phenylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[[2-(2-phenylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-chloro-3-nitro-N-[[[1-oxo-2-(2-phenylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[[[2-(2-phenylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C22H17ClN4O5S MolecularWeight: 484.91218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2OCC(=O)NNC(=S)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2OCC(=O)NNC(=S)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H17ClN4O5S/c23-17-11-10-15(12-18(17)27(30)31)21(29)24-22(33)26-25-20(28)13-32-19-9-5-4-8-16(19)14-6-2-1-3-7-14/h1-12H,13H2,(H,25,28)(H2,24,26,29,33)