N-(4-ethylsulfanylphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-ethylsulfanylphenyl)-3-nitro-benzenesulfonamide Openeye Name: N-(4-ethylsulfanylphenyl)-3-nitro-benzenesulfonamide CAS Name: N-[4-(ethylthio)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(4-ethylsulfanylphenyl)-3-nitrobenzenesulfonamide Traditional Name: N-[4-(ethylthio)phenyl]-3-nitro-benzenesulfonamide Formula: C14H14N2O4S2 MolecularWeight: 338.40196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCSC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O4S2/c1-2-21-13-8-6-11(7-9-13)15-22(19,20)14-5-3-4-12(10-14)16(17)18/h3-10,15H,2H2,1H3