3-[[2-(2-chlorophenyl)sulfanylethanoylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[[2-(2-chlorophenyl)sulfanylethanoylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[[2-(2-chlorophenyl)sulfanylacetyl]amino]carbamoyl]benzenesulfonamide CAS Name: 3-[[[2-[(2-chlorophenyl)thio]-1-oxoethyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[[2-(2-chlorophenyl)sulfanylacetyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[[2-[(2-chlorophenyl)thio]acetyl]amino]carbamoyl]benzenesulfonamide Formula: C22H20ClN3O4S2 MolecularWeight: 489.9949

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CSC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CSC3=CC=CC=C3Cl

InChI

InChI=1S/C22H20ClN3O4S2/c23-19-11-4-5-12-20(19)31-15-21(27)25-26-22(28)17-9-6-10-18(13-17)32(29,30)24-14-16-7-2-1-3-8-16/h1-13,24H,14-15H2,(H,25,27)(H,26,28)