4-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-N-ethyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-N-ethyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-N-ethyl-benzenesulfonamide CAS Name: 4-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-N-ethyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-N-ethylbenzenesulfonamide Traditional Name: N-benzyl-4-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-N-ethyl-benzenesulfonamide Formula: C27H33N3O4S2 MolecularWeight: 527.69862

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C

InChI

InChI=1S/C27H33N3O4S2/c1-4-29(21-24-10-6-5-7-11-24)35(31,32)25-13-15-26(16-14-25)36(33,34)30-19-17-28(18-20-30)27-12-8-9-22(2)23(27)3/h5-16H,4,17-21H2,1-3H3