3-nitro-N-[[4-[4-[(3-nitrophenyl)carbonylcarbamothioylamino]phenyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-nitro-N-[[4-[4-[(3-nitrophenyl)carbonylcarbamothioylamino]phenyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-nitro-N-[[4-[4-[(3-nitrobenzoyl)carbamothioylamino]phenyl]phenyl]carbamothioyl]benzamide CAS Name: 3-nitro-N-[[4-[4-[[[[(3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-nitro-N-[[4-[4-[(3-nitrobenzoyl)carbamothioylamino]phenyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-nitro-N-[[4-[4-[(3-nitrobenzoyl)thiocarbamoylamino]phenyl]phenyl]thiocarbamoyl]benzamide Formula: C28H20N6O6S2 MolecularWeight: 600.625

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=CC=C(C=C2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=CC=C(C=C2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H20N6O6S2/c35-25(19-3-1-5-23(15-19)33(37)38)31-27(41)29-21-11-7-17(8-12-21)18-9-13-22(14-10-18)30-28(42)32-26(36)20-4-2-6-24(16-20)34(39)40/h1-16H,(H2,29,31,35,41)(H2,30,32,36,42)