4-chloranyl-N-(2-methylsulfanylphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-methylsulfanylphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(2-methylsulfanylphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[2-(methylthio)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(2-methylsulfanylphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[2-(methylthio)phenyl]-3-nitro-benzenesulfonamide Formula: C13H11ClN2O4S2 MolecularWeight: 358.82044

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClN2O4S2/c1-21-13-5-3-2-4-11(13)15-22(19,20)9-6-7-10(14)12(8-9)16(17)18/h2-8,15H,1H3