N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-4-nitro-benzenesulfonamide Formula: C13H14N2O5S2 MolecularWeight: 342.39066

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CSCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O5S2/c16-15(17)11-3-5-13(6-4-11)22(18,19)14-7-9-21-10-12-2-1-8-20-12/h1-6,8,14H,7,9-10H2