4-chloranyl-3-nitro-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[[(4-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-chloro-3-nitro-N-[[[(4-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[[(4-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[[(4-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C15H10ClN5O6S MolecularWeight: 423.7878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10ClN5O6S/c16-11-6-3-9(7-12(11)21(26)27)13(22)17-15(28)19-18-14(23)8-1-4-10(5-2-8)20(24)25/h1-7H,(H,18,23)(H2,17,19,22,28)