2-chloranyl-N,N-dimethyl-5-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-N,N-dimethyl-5-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 2-chloro-N,N-dimethyl-5-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 2-chloro-N,N-dimethyl-5-[oxo-[4-[2-(phenylthio)ethyl]-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 2-chloro-N,N-dimethyl-5-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 2-chloro-N,N-dimethyl-5-[4-[2-(phenylthio)ethyl]piperazine-1-carbonyl]benzenesulfonamide Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CCSC3=CC=CC=C3)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CCSC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H26ClN3O3S2/c1-23(2)30(27,28)20-16-17(8-9-19(20)22)21(26)25-12-10-24(11-13-25)14-15-29-18-6-4-3-5-7-18/h3-9,16H,10-15H2,1-2H3