2-nitro-N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-nitro-N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-nitro-N-[[(2-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-nitro-N-[[[(2-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-nitro-N-[[(2-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2-nitro-N-[[(2-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C15H11N5O6S MolecularWeight: 389.34274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N5O6S/c21-13(9-5-1-3-7-11(9)19(23)24)16-15(27)18-17-14(22)10-6-2-4-8-12(10)20(25)26/h1-8H,(H,17,22)(H2,16,18,21,27)