N,N-diethyl-2-methyl-5-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N,N-diethyl-2-methyl-5-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 5-[4-(benzenesulfonyl)piperazine-1-carbonyl]-N,N-diethyl-2-methyl-benzenesulfonamide CAS Name: 5-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-N,N-diethyl-2-methylbenzenesulfonamide IUPAC Name: 5-[4-(benzenesulfonyl)piperazine-1-carbonyl]-N,N-diethyl-2-methylbenzenesulfonamide Traditional Name: 5-(4-besylpiperazine-1-carbonyl)-N,N-diethyl-2-methyl-benzenesulfonamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O5S2/c1-4-24(5-2)32(29,30)21-17-19(12-11-18(21)3)22(26)23-13-15-25(16-14-23)31(27,28)20-9-7-6-8-10-20/h6-12,17H,4-5,13-16H2,1-3H3