N-(4-chlorophenyl)-4-isothiocyanato-benzenesulfonamide

Systemtic Name: N-(4-chlorophenyl)-4-isothiocyanato-benzenesulfonamide Openeye Name: N-(4-chlorophenyl)-4-isothiocyanato-benzenesulfonamide CAS Name: N-(4-chlorophenyl)-4-isothiocyanatobenzenesulfonamide IUPAC Name: N-(4-chlorophenyl)-4-isothiocyanatobenzenesulfonamide Traditional Name: N-(4-chlorophenyl)-4-isothiocyanato-benzenesulfonamide Formula: C13H9ClN2O2S2 MolecularWeight: 324.80576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NS(=O)(=O)C2=CC=C(C=C2)N=C=S)Cl

Isomeric SMILES

C1=CC(=CC=C1NS(=O)(=O)C2=CC=C(C=C2)N=C=S)Cl

InChI

InChI=1S/C13H9ClN2O2S2/c14-10-1-3-12(4-2-10)16-20(17,18)13-7-5-11(6-8-13)15-9-19/h1-8,16H