N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2,4-dimethyl-benzenesulfonamide Openeye Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2,4-dimethyl-benzenesulfonamide CAS Name: N-[2-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]ethyl]-2,4-dimethylbenzenesulfonamide IUPAC Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2,4-dimethylbenzenesulfonamide Traditional Name: N-[2-[4-(3-chlorophenyl)piperazino]sulfonylethyl]-2,4-dimethyl-benzenesulfonamide Formula: C20H26ClN3O4S2 MolecularWeight: 472.02114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C20H26ClN3O4S2/c1-16-6-7-20(17(2)14-16)30(27,28)22-8-13-29(25,26)24-11-9-23(10-12-24)19-5-3-4-18(21)15-19/h3-7,14-15,22H,8-13H2,1-2H3