4-[2-(4-cyano-2-nitro-phenyl)sulfanylethylsulfanyl]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[2-(4-cyano-2-nitro-phenyl)sulfanylethylsulfanyl]-3-nitro-benzenecarbonitrile Openeye Name: 4-[2-(4-cyano-2-nitro-phenyl)sulfanylethylsulfanyl]-3-nitro-benzonitrile CAS Name: 4-[2-[(4-cyano-2-nitrophenyl)thio]ethylthio]-3-nitrobenzonitrile IUPAC Name: 4-[2-(4-cyano-2-nitrophenyl)sulfanylethylsulfanyl]-3-nitrobenzonitrile Traditional Name: 4-[2-[(4-cyano-2-nitro-phenyl)thio]ethylthio]-3-nitro-benzonitrile Formula: C16H10N4O4S2 MolecularWeight: 386.405

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])SCCSC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])SCCSC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H10N4O4S2/c17-9-11-1-3-15(13(7-11)19(21)22)25-5-6-26-16-4-2-12(10-18)8-14(16)20(23)24/h1-4,7-8H,5-6H2