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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

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