3-nitro-4-[2-[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]carbonylhydrazinyl]benzenesulfonamide

Systemtic Name: 3-nitro-4-[2-[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]carbonylhydrazinyl]benzenesulfonamide Openeye Name: 3-nitro-4-[2-[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoyl]hydrazino]benzenesulfonamide CAS Name: 3-nitro-4-[[[3-nitro-4-(1H-1,2,4-triazol-5-ylthio)phenyl]-oxomethyl]hydrazo]benzenesulfonamide IUPAC Name: 3-nitro-4-[2-[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoyl]hydrazinyl]benzenesulfonamide Traditional Name: 3-nitro-4-[N'-[3-nitro-4-(1H-1,2,4-triazol-5-ylthio)benzoyl]hydrazino]benzenesulfonamide Formula: C15H12N8O7S2 MolecularWeight: 480.43518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])[N+](=O)[O-])SC3=NC=NN3

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])[N+](=O)[O-])SC3=NC=NN3

InChI

InChI=1S/C15H12N8O7S2/c16-32(29,30)9-2-3-10(11(6-9)22(25)26)19-20-14(24)8-1-4-13(12(5-8)23(27)28)31-15-17-7-18-21-15/h1-7,19H,(H,20,24)(H2,16,29,30)(H,17,18,21)