4-chloranyl-N,N-diethyl-3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N,N-diethyl-3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-chloro-N,N-diethyl-3-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-chloro-N,N-diethyl-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: 4-chloro-N,N-diethyl-3-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-chloro-N,N-diethyl-3-(4-tosylpiperazine-1-carbonyl)benzenesulfonamide Formula: C22H28ClN3O5S2 MolecularWeight: 514.05782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O5S2/c1-4-25(5-2)33(30,31)19-10-11-21(23)20(16-19)22(27)24-12-14-26(15-13-24)32(28,29)18-8-6-17(3)7-9-18/h6-11,16H,4-5,12-15H2,1-3H3