2-[3,5-bis(chloranyl)phenyl]sulfanyl-6-nitro-benzenecarbonitrile

Systemtic Name: 2-[3,5-bis(chloranyl)phenyl]sulfanyl-6-nitro-benzenecarbonitrile Openeye Name: 2-(3,5-dichlorophenyl)sulfanyl-6-nitro-benzonitrile CAS Name: 2-[(3,5-dichlorophenyl)thio]-6-nitrobenzonitrile IUPAC Name: 2-(3,5-dichlorophenyl)sulfanyl-6-nitrobenzonitrile Traditional Name: 2-[(3,5-dichlorophenyl)thio]-6-nitro-benzonitrile Formula: C13H6Cl2N2O2S MolecularWeight: 325.16994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)SC2=CC(=CC(=C2)Cl)Cl)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)SC2=CC(=CC(=C2)Cl)Cl)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H6Cl2N2O2S/c14-8-4-9(15)6-10(5-8)20-13-3-1-2-12(17(18)19)11(13)7-16/h1-6H