4-(2-chloroethylsulfanyl)-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2-chloroethylsulfanyl)-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-(2-chloroethylsulfanyl)-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-(2-chloroethylthio)-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(2-chloroethylsulfanyl)-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-(2-chloroethylthio)-N-methyl-3-nitro-benzenesulfonamide Formula: C9H11ClN2O4S2 MolecularWeight: 310.77764

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)SCCCl)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)SCCCl)[N+](=O)[O-]

InChI

InChI=1S/C9H11ClN2O4S2/c1-11-18(15,16)7-2-3-9(17-5-4-10)8(6-7)12(13)14/h2-3,6,11H,4-5H2,1H3